ethyl (E)-3-[[4-chloranyl-3-(cyclohexylcarbamoyl)phenyl]amino]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[[4-chloranyl-3-(cyclohexylcarbamoyl)phenyl]amino]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[4-chloro-3-(cyclohexylcarbamoyl)anilino]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-chloro-3-[(cyclohexylamino)-oxomethyl]anilino]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-chloro-3-(cyclohexylcarbamoyl)anilino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-chloro-3-(cyclohexylcarbamoyl)anilino]-2-cyano-acrylic acid ethyl ester Formula: C19H22ClN3O3 MolecularWeight: 375.84928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC(=C(C=C1)Cl)C(=O)NC2CCCCC2)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC(=C(C=C1)Cl)C(=O)NC2CCCCC2)/C#N

InChI

InChI=1S/C19H22ClN3O3/c1-2-26-19(25)13(11-21)12-22-15-8-9-17(20)16(10-15)18(24)23-14-6-4-3-5-7-14/h8-10,12,14,22H,2-7H2,1H3,(H,23,24)/b13-12+