N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-[1-(1-methyl-2-phenyl-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]pentanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-[1-(1-methyl-2-phenyl-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]pentanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-[1-(1-methyl-2-phenyl-indol-3-yl)-3-oxo-isoindolin-2-yl]pentanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-[1-(1-methyl-2-phenyl-3-indolyl)-3-oxo-1H-isoindol-2-yl]pentanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-methyl-2-[1-(1-methyl-2-phenylindol-3-yl)-3-oxo-1H-isoindol-2-yl]pentanamide Traditional Name: 2-[1-keto-3-(1-methyl-2-phenyl-indol-3-yl)isoindolin-2-yl]-3-methyl-N-piperonyl-valeramide Formula: C37H35N3O4 MolecularWeight: 585.6915

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC1=CC2=C(C=C1)OCO2)N3C(C4=CC=CC=C4C3=O)C5=C(N(C6=CC=CC=C65)C)C7=CC=CC=C7

Isomeric SMILES

CCC(C)C(C(=O)NCC1=CC2=C(C=C1)OCO2)N3C(C4=CC=CC=C4C3=O)C5=C(N(C6=CC=CC=C65)C)C7=CC=CC=C7

InChI

InChI=1S/C37H35N3O4/c1-4-23(2)33(36(41)38-21-24-18-19-30-31(20-24)44-22-43-30)40-35(26-14-8-9-15-27(26)37(40)42)32-28-16-10-11-17-29(28)39(3)34(32)25-12-6-5-7-13-25/h5-20,23,33,35H,4,21-22H2,1-3H3,(H,38,41)