N-(1,3-benzodioxol-5-ylmethyl)-4-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)-4-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)-4-methyl-2-[1-(1-methyl-2-phenyl-indol-3-yl)-3-oxo-isoindolin-2-yl]pentanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[1-(1-methyl-2-phenyl-3-indolyl)-3-oxo-1H-isoindol-2-yl]pentanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-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]-4-methyl-N-piperonyl-valeramide Formula: C37H35N3O4 MolecularWeight: 585.6915

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(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

CC(C)CC(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/c1-23(2)19-30(36(41)38-21-24-17-18-31-32(20-24)44-22-43-31)40-35(26-13-7-8-14-27(26)37(40)42)33-28-15-9-10-16-29(28)39(3)34(33)25-11-5-4-6-12-25/h4-18,20,23,30,35H,19,21-22H2,1-3H3,(H,38,41)