ethyl (E)-2-cyano-3-[(3-ethoxy-3-oxidanylidene-propyl)-(phenylmethyl)amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[(3-ethoxy-3-oxidanylidene-propyl)-(phenylmethyl)amino]prop-2-enoate Openeye Name: ethyl (E)-3-[benzyl-(3-ethoxy-3-oxo-propyl)amino]-2-cyano-prop-2-enoate CAS Name: (E)-2-cyano-3-[(3-ethoxy-3-oxopropyl)-(phenylmethyl)amino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[benzyl-(3-ethoxy-3-oxopropyl)amino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[benzyl-(3-ethoxy-3-keto-propyl)amino]-2-cyano-acrylic acid ethyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)C=C(C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)/C=C(\C#N)/C(=O)OCC

InChI

InChI=1S/C18H22N2O4/c1-3-23-17(21)10-11-20(13-15-8-6-5-7-9-15)14-16(12-19)18(22)24-4-2/h5-9,14H,3-4,10-11,13H2,1-2H3/b16-14+