N-(3-bromophenyl)-1-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxamide

Systemtic Name: N-(3-bromophenyl)-1-[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]piperidine-4-carboxamide Openeye Name: N-(3-bromophenyl)-1-[2-(3,4-dimethoxyanilino)-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: N-(3-bromophenyl)-1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]-4-piperidinecarboxamide IUPAC Name: N-(3-bromophenyl)-1-[2-(3,4-dimethoxyanilino)-2-oxoethyl]piperidine-4-carboxamide Traditional Name: N-(3-bromophenyl)-1-[2-(3,4-dimethoxyanilino)-2-keto-ethyl]isonipecotamide Formula: C22H26BrN3O4 MolecularWeight: 476.36354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)NC3=CC(=CC=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)NC3=CC(=CC=C3)Br)OC

InChI

InChI=1S/C22H26BrN3O4/c1-29-19-7-6-18(13-20(19)30-2)24-21(27)14-26-10-8-15(9-11-26)22(28)25-17-5-3-4-16(23)12-17/h3-7,12-13,15H,8-11,14H2,1-2H3,(H,24,27)(H,25,28)