ethyl (E)-3-[[4-(butan-2-ylcarbamoyl)phenyl]amino]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[[4-(butan-2-ylcarbamoyl)phenyl]amino]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[4-(sec-butylcarbamoyl)anilino]prop-2-enoate CAS Name: (E)-3-[4-[(butan-2-ylamino)-oxomethyl]anilino]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-(butan-2-ylcarbamoyl)anilino]-2-cyanoprop-2-enoate Traditional Name: (E)-2-cyano-3-[4-(sec-butylcarbamoyl)anilino]acrylic acid ethyl ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=C(C=C1)NC=C(C#N)C(=O)OCC

Isomeric SMILES

CCC(C)NC(=O)C1=CC=C(C=C1)N/C=C(\C#N)/C(=O)OCC

InChI

InChI=1S/C17H21N3O3/c1-4-12(3)20-16(21)13-6-8-15(9-7-13)19-11-14(10-18)17(22)23-5-2/h6-9,11-12,19H,4-5H2,1-3H3,(H,20,21)/b14-11+