4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]-1-methyl-N-(1-methylindol-5-yl)piperidine-4-carboxamide

Systemtic Name: 4-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyl-[2-(3,4-dimethoxyphenyl)ethyl]amino]-1-methyl-N-(1-methylindol-5-yl)piperidine-4-carboxamide Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-[2-(1,3-dioxoisoindolin-2-yl)acetyl]amino]-1-methyl-N-(1-methylindol-5-yl)piperidine-4-carboxamide CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-[2-(1,3-dioxo-2-isoindolyl)-1-oxoethyl]amino]-1-methyl-N-(1-methyl-5-indolyl)-4-piperidinecarboxamide IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-[2-(1,3-dioxoisoindol-2-yl)acetyl]amino]-1-methyl-N-(1-methylindol-5-yl)piperidine-4-carboxamide Traditional Name: 4-[homoveratryl-(2-phthalimidoacetyl)amino]-1-methyl-N-(1-methylindol-5-yl)isonipecotamide Formula: C36H39N5O6 MolecularWeight: 637.72476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(C(=O)NC2=CC3=C(C=C2)N(C=C3)C)N(CCC4=CC(=C(C=C4)OC)OC)C(=O)CN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

CN1CCC(CC1)(C(=O)NC2=CC3=C(C=C2)N(C=C3)C)N(CCC4=CC(=C(C=C4)OC)OC)C(=O)CN5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C36H39N5O6/c1-38-19-15-36(16-20-38,35(45)37-26-10-11-29-25(22-26)14-17-39(29)2)41(18-13-24-9-12-30(46-3)31(21-24)47-4)32(42)23-40-33(43)27-7-5-6-8-28(27)34(40)44/h5-12,14,17,21-22H,13,15-16,18-20,23H2,1-4H3,(H,37,45)