(E)-2-cyano-3-[4-(methylamino)-3-nitro-phenyl]-N-[(1R)-1-phenylethyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[4-(methylamino)-3-nitro-phenyl]-N-[(1R)-1-phenylethyl]prop-2-enamide Openeye Name: (E)-2-cyano-3-[4-(methylamino)-3-nitro-phenyl]-N-[(1R)-1-phenylethyl]prop-2-enamide CAS Name: (E)-2-cyano-3-[4-(methylamino)-3-nitrophenyl]-N-[(1R)-1-phenylethyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-[4-(methylamino)-3-nitrophenyl]-N-[(1R)-1-phenylethyl]prop-2-enamide Traditional Name: (E)-2-cyano-3-[4-(methylamino)-3-nitro-phenyl]-N-[(1R)-1-phenylethyl]acrylamide Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(=CC2=CC(=C(C=C2)NC)[N+](=O)[O-])C#N

Isomeric SMILES

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

InChI

InChI=1S/C19H18N4O3/c1-13(15-6-4-3-5-7-15)22-19(24)16(12-20)10-14-8-9-17(21-2)18(11-14)23(25)26/h3-11,13,21H,1-2H3,(H,22,24)/b16-10+/t13-/m1/s1