1-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[2-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[2-(2,5-dimethyl-1-piperonyl-pyrrol-3-yl)-2-keto-ethyl]-N-phenyl-isonipecotamide Formula: C28H31N3O4 MolecularWeight: 473.56344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)CN4CCC(CC4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)CN4CCC(CC4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C28H31N3O4/c1-19-14-24(20(2)31(19)16-21-8-9-26-27(15-21)35-18-34-26)25(32)17-30-12-10-22(11-13-30)28(33)29-23-6-4-3-5-7-23/h3-9,14-15,22H,10-13,16-18H2,1-2H3,(H,29,33)