prop-2-enyl N-[(7S,10aR)-9-aminocarbonyl-4,7-bis(dimethylamino)-1,8,10a,12-tetrakis(oxidanyl)-10,11-bis(oxidanylidene)-5a,6,6a,7,8,9-hexahydro-5H-tetracen-2-yl]carbamate

Systemtic Name: prop-2-enyl N-[(7S,10aR)-9-aminocarbonyl-4,7-bis(dimethylamino)-1,8,10a,12-tetrakis(oxidanyl)-10,11-bis(oxidanylidene)-5a,6,6a,7,8,9-hexahydro-5H-tetracen-2-yl]carbamate Openeye Name: allyl N-[(7S,10aR)-9-carbamoyl-4,7-bis(dimethylamino)-1,8,10a,12-tetrahydroxy-10,11-dioxo-5a,6,6a,7,8,9-hexahydro-5H-tetracen-2-yl]carbamate CAS Name: N-[(7S,10aR)-9-carbamoyl-4,7-bis(dimethylamino)-1,8,10a,12-tetrahydroxy-10,11-dioxo-5a,6,6a,7,8,9-hexahydro-5H-tetracen-2-yl]carbamic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N-[(7S,10aR)-9-carbamoyl-4,7-bis(dimethylamino)-1,8,10a,12-tetrahydroxy-10,11-dioxo-5a,6,6a,7,8,9-hexahydro-5H-tetracen-2-yl]carbamate Traditional Name: N-[(7S,10aR)-9-carbamoyl-4,7-bis(dimethylamino)-1,8,10a,12-tetrahydroxy-10,11-diketo-5a,6,6a,7,8,9-hexahydro-5H-tetracen-2-yl]carbamic acid allyl ester Formula: C27H34N4O9 MolecularWeight: 558.58026

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1C2CC3CC4=C(C(=C(C=C4N(C)C)NC(=O)OCC=C)O)C(=C3C(=O)C2(C(=O)C(C1O)C(=O)N)O)O

Isomeric SMILES

CN(C)[C@H]1C2CC3CC4=C(C(=C(C=C4N(C)C)NC(=O)OCC=C)O)C(=C3C(=O)[C@@]2(C(=O)C(C1O)C(=O)N)O)O

InChI

InChI=1S/C27H34N4O9/c1-6-7-40-26(38)29-14-10-15(30(2)3)12-8-11-9-13-19(31(4)5)22(34)18(25(28)37)24(36)27(13,39)23(35)16(11)21(33)17(12)20(14)32/h6,10-11,13,18-19,22,32-34,39H,1,7-9H2,2-5H3,(H2,28,37)(H,29,38)/t11?,13?,18?,19-,22?,27-/m0/s1