N-[(7S)-1,2,3-trimethoxy-10-(4-methylpiperazin-1-yl)-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl]ethanamide

Systemtic Name: N-[(7S)-1,2,3-trimethoxy-10-(4-methylpiperazin-1-yl)-9-oxidanylidene-6,7-dihydro-5H-benzo[a]heptalen-7-yl]ethanamide Openeye Name: N-[(7S)-1,2,3-trimethoxy-10-(4-methylpiperazin-1-yl)-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide CAS Name: N-[(7S)-1,2,3-trimethoxy-10-(4-methyl-1-piperazinyl)-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide IUPAC Name: N-[(7S)-1,2,3-trimethoxy-10-(4-methylpiperazin-1-yl)-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide Traditional Name: N-[(7S)-9-keto-1,2,3-trimethoxy-10-(4-methylpiperazino)-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide Formula: C26H33N3O5 MolecularWeight: 467.55732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)N4CCN(CC4)C)OC)OC)OC

Isomeric SMILES

CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)N4CCN(CC4)C)OC)OC)OC

InChI

InChI=1S/C26H33N3O5/c1-16(30)27-20-8-6-17-14-23(32-3)25(33-4)26(34-5)24(17)18-7-9-21(22(31)15-19(18)20)29-12-10-28(2)11-13-29/h7,9,14-15,20H,6,8,10-13H2,1-5H3,(H,27,30)/t20-/m0/s1