ethyl (E)-2-cyano-3-[[2-[(4-ethylphenyl)carbamoyl]phenyl]amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[[2-[(4-ethylphenyl)carbamoyl]phenyl]amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[2-[(4-ethylphenyl)carbamoyl]anilino]prop-2-enoate CAS Name: (E)-2-cyano-3-[2-[(4-ethylanilino)-oxomethyl]anilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[2-[(4-ethylphenyl)carbamoyl]anilino]prop-2-enoate Traditional Name: (E)-2-cyano-3-[2-[(4-ethylphenyl)carbamoyl]anilino]acrylic acid ethyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC=C(C#N)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2N/C=C(\C#N)/C(=O)OCC

InChI

InChI=1S/C21H21N3O3/c1-3-15-9-11-17(12-10-15)24-20(25)18-7-5-6-8-19(18)23-14-16(13-22)21(26)27-4-2/h5-12,14,23H,3-4H2,1-2H3,(H,24,25)/b16-14+