methyl (E)-3-[[3-(butylcarbamoyl)phenyl]amino]-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-[[3-(butylcarbamoyl)phenyl]amino]-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-[3-(butylcarbamoyl)anilino]-2-cyano-prop-2-enoate CAS Name: (E)-3-[3-[butylamino(oxo)methyl]anilino]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-(butylcarbamoyl)anilino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[3-(butylcarbamoyl)anilino]-2-cyano-acrylic acid methyl ester Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=CC=C1)NC=C(C#N)C(=O)OC

Isomeric SMILES

CCCCNC(=O)C1=CC(=CC=C1)N/C=C(\C#N)/C(=O)OC

InChI

InChI=1S/C16H19N3O3/c1-3-4-8-18-15(20)12-6-5-7-14(9-12)19-11-13(10-17)16(21)22-2/h5-7,9,11,19H,3-4,8H2,1-2H3,(H,18,20)/b13-11+