1-[(E)-3-[(3-chlorophenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]piperidine-4-carboxamide

Systemtic Name: 1-[(E)-3-[(3-chlorophenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]piperidine-4-carboxamide Openeye Name: 1-[(E)-3-(3-chloroanilino)-2-cyano-3-oxo-prop-1-enyl]piperidine-4-carboxamide CAS Name: 1-[(E)-3-(3-chloroanilino)-2-cyano-3-oxoprop-1-enyl]-4-piperidinecarboxamide IUPAC Name: 1-[(E)-3-(3-chloroanilino)-2-cyano-3-oxoprop-1-enyl]piperidine-4-carboxamide Traditional Name: 1-[(E)-3-(3-chloroanilino)-2-cyano-3-keto-prop-1-enyl]isonipecotamide Formula: C16H17ClN4O2 MolecularWeight: 332.78478

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C=C(C#N)C(=O)NC2=CC(=CC=C2)Cl

Isomeric SMILES

C1CN(CCC1C(=O)N)/C=C(\C#N)/C(=O)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C16H17ClN4O2/c17-13-2-1-3-14(8-13)20-16(23)12(9-18)10-21-6-4-11(5-7-21)15(19)22/h1-3,8,10-11H,4-7H2,(H2,19,22)(H,20,23)/b12-10+