ethyl (E)-3-[[4-(azepan-1-ylcarbonyl)phenyl]amino]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[[4-(azepan-1-ylcarbonyl)phenyl]amino]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[4-(azepane-1-carbonyl)anilino]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-[1-azepanyl(oxo)methyl]anilino]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-(azepane-1-carbonyl)anilino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-(azepane-1-carbonyl)anilino]-2-cyano-acrylic acid ethyl ester Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=C(C=C1)C(=O)N2CCCCCC2)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC=C(C=C1)C(=O)N2CCCCCC2)/C#N

InChI

InChI=1S/C19H23N3O3/c1-2-25-19(24)16(13-20)14-21-17-9-7-15(8-10-17)18(23)22-11-5-3-4-6-12-22/h7-10,14,21H,2-6,11-12H2,1H3/b16-14+