N-(1,3-benzodioxol-5-ylmethyl)-1-[4-[(4-methylphenyl)amino]-4-oxidanylidene-butanoyl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[4-[(4-methylphenyl)amino]-4-oxidanylidene-butanoyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[4-(4-methylanilino)-4-oxo-butanoyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[4-(4-methylanilino)-1,4-dioxobutyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[4-(4-methylanilino)-4-oxobutanoyl]piperidine-4-carboxamide Traditional Name: 1-[4-keto-4-(p-toluidino)butanoyl]-N-piperonyl-isonipecotamide Formula: C25H29N3O5 MolecularWeight: 451.51486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCC(=O)N2CCC(CC2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCC(=O)N2CCC(CC2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H29N3O5/c1-17-2-5-20(6-3-17)27-23(29)8-9-24(30)28-12-10-19(11-13-28)25(31)26-15-18-4-7-21-22(14-18)33-16-32-21/h2-7,14,19H,8-13,15-16H2,1H3,(H,26,31)(H,27,29)