N-[(7S)-1,2-dimethoxy-10-(methylamino)-3-oxidanyl-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl]ethanamide

Systemtic Name: N-[(7S)-1,2-dimethoxy-10-(methylamino)-3-oxidanyl-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl]ethanamide Openeye Name: N-[(7S)-3-hydroxy-1,2-dimethoxy-10-(methylamino)-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide CAS Name: N-[(7S)-3-hydroxy-1,2-dimethoxy-10-(methylamino)-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide IUPAC Name: N-[(7S)-3-hydroxy-1,2-dimethoxy-10-(methylamino)-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide Traditional Name: N-[(7S)-3-hydroxy-9-keto-1,2-dimethoxy-10-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)NC)OC)OC)O

Isomeric SMILES

CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)NC)OC)OC)O

InChI

InChI=1S/C21H24N2O5/c1-11(24)23-15-7-5-12-9-18(26)20(27-3)21(28-4)19(12)13-6-8-16(22-2)17(25)10-14(13)15/h6,8-10,15,26H,5,7H2,1-4H3,(H,22,25)(H,23,24)/t15-/m0/s1