ethyl (E)-2-cyano-3-[(4-nitrophenyl)amino]-3-[[(1R)-1-phenylethyl]amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[(4-nitrophenyl)amino]-3-[[(1R)-1-phenylethyl]amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-(4-nitroanilino)-3-[[(1R)-1-phenylethyl]amino]prop-2-enoate CAS Name: (E)-2-cyano-3-(4-nitroanilino)-3-[[(1R)-1-phenylethyl]amino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-(4-nitroanilino)-3-[[(1R)-1-phenylethyl]amino]prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-nitroanilino)-3-[[(1R)-1-phenylethyl]amino]acrylic acid ethyl ester Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(NC1=CC=C(C=C1)[N+](=O)[O-])NC(C)C2=CC=CC=C2)C#N

Isomeric SMILES

CCOC(=O)/C(=C(/NC1=CC=C(C=C1)[N+](=O)[O-])\N[C@H](C)C2=CC=CC=C2)/C#N

InChI

InChI=1S/C20H20N4O4/c1-3-28-20(25)18(13-21)19(22-14(2)15-7-5-4-6-8-15)23-16-9-11-17(12-10-16)24(26)27/h4-12,14,22-23H,3H2,1-2H3/b19-18+/t14-/m1/s1