N-(1,3-benzodioxol-5-yl)-1-[2-[(2,3-dimethylphenyl)amino]phenyl]carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[2-[(2,3-dimethylphenyl)amino]phenyl]carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[2-(2,3-dimethylanilino)benzoyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[[2-(2,3-dimethylanilino)phenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[2-(2,3-dimethylanilino)benzoyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[2-(2,3-dimethylanilino)benzoyl]isonipecotamide Formula: C28H29N3O4 MolecularWeight: 471.54756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=CC=CC=C2C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=CC=CC=C2C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C28H29N3O4/c1-18-6-5-9-23(19(18)2)30-24-8-4-3-7-22(24)28(33)31-14-12-20(13-15-31)27(32)29-21-10-11-25-26(16-21)35-17-34-25/h3-11,16,20,30H,12-15,17H2,1-2H3,(H,29,32)