2-[2-[5-[(4-methoxyphenyl)methyl]-4-oxidanylidene-2,3,3a,10a-tetrahydro-1H-cyclopenta[b][1,5]benzodiazepin-10-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[5-[(4-methoxyphenyl)methyl]-4-oxidanylidene-2,3,3a,10a-tetrahydro-1H-cyclopenta[b][1,5]benzodiazepin-10-yl]-2-oxidanylidene-ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[5-[(4-methoxyphenyl)methyl]-4-oxo-2,3,3a,10a-tetrahydro-1H-cyclopenta[b][1,5]benzodiazepin-10-yl]-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[5-[(4-methoxyphenyl)methyl]-4-oxo-2,3,3a,10a-tetrahydro-1H-cyclopenta[b][1,5]benzodiazepin-10-yl]-2-oxoethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[5-[(4-methoxyphenyl)methyl]-4-oxo-2,3,3a,10a-tetrahydro-1H-cyclopenta[b][1,5]benzodiazepin-10-yl]-2-oxoethyl]isoindole-1,3-dione Traditional Name: 2-[2-keto-2-(4-keto-5-p-anisyl-2,3,3a,10a-tetrahydro-1H-cyclopenta[b][1,5]benzodiazepin-10-yl)ethyl]isoindoline-1,3-quinone Formula: C30H27N3O5 MolecularWeight: 509.55248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=CC=CC=C3N(C4CCCC4C2=O)C(=O)CN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=CC=CC=C3N(C4CCCC4C2=O)C(=O)CN5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C30H27N3O5/c1-38-20-15-13-19(14-16-20)17-31-25-10-4-5-11-26(25)33(24-12-6-9-23(24)30(31)37)27(34)18-32-28(35)21-7-2-3-8-22(21)29(32)36/h2-5,7-8,10-11,13-16,23-24H,6,9,12,17-18H2,1H3