(5S,6R)-4-(dimethylamino)-6-methyl-9-(naphthalen-1-ylcarbamoylamino)-3,5,10,11-tetrakis(oxidanyl)-1,12-bis(oxidanylidene)-2,3,4,4a,5,5a,6,12a-octahydrotetracene-2-carboxamide

Systemtic Name: (5S,6R)-4-(dimethylamino)-6-methyl-9-(naphthalen-1-ylcarbamoylamino)-3,5,10,11-tetrakis(oxidanyl)-1,12-bis(oxidanylidene)-2,3,4,4a,5,5a,6,12a-octahydrotetracene-2-carboxamide Openeye Name: (5S,6R)-4-(dimethylamino)-3,5,10,11-tetrahydroxy-6-methyl-9-(1-naphthylcarbamoylamino)-1,12-dioxo-2,3,4,4a,5,5a,6,12a-octahydrotetracene-2-carboxamide CAS Name: (5S,6R)-4-(dimethylamino)-3,5,10,11-tetrahydroxy-6-methyl-9-[[(1-naphthalenylamino)-oxomethyl]amino]-1,12-dioxo-2,3,4,4a,5,5a,6,12a-octahydrotetracene-2-carboxamide IUPAC Name: (5S,6R)-4-(dimethylamino)-3,5,10,11-tetrahydroxy-6-methyl-9-(naphthalen-1-ylcarbamoylamino)-1,12-dioxo-2,3,4,4a,5,5a,6,12a-octahydrotetracene-2-carboxamide Traditional Name: (5S,6R)-4-(dimethylamino)-3,5,10,11-tetrahydroxy-1,12-diketo-6-methyl-9-(1-naphthylcarbamoylamino)-2,3,4,4a,5,5a,6,12a-octahydrotetracene-2-carboxamide Formula: C33H34N4O8 MolecularWeight: 614.64506

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2C(C3C(C(C(C(=O)C3C(=O)C2=C(C4=C1C=CC(=C4O)NC(=O)NC5=CC=CC6=CC=CC=C65)O)C(=O)N)O)N(C)C)O

Isomeric SMILES

C[C@@H]1C2[C@@H](C3C(C(C(C(=O)C3C(=O)C2=C(C4=C1C=CC(=C4O)NC(=O)NC5=CC=CC6=CC=CC=C65)O)C(=O)N)O)N(C)C)O

InChI

InChI=1S/C33H34N4O8/c1-13-15-11-12-18(36-33(45)35-17-10-6-8-14-7-4-5-9-16(14)17)26(38)20(15)28(40)22-19(13)27(39)21-23(29(22)41)30(42)24(32(34)44)31(43)25(21)37(2)3/h4-13,19,21,23-25,27,31,38-40,43H,1-3H3,(H2,34,44)(H2,35,36,45)/t13-,19?,21?,23?,24?,25?,27-,31?/m0/s1