ethyl (2Z,3S)-3-methyl-4-nitro-2-[phenyl-[[(1R)-1-phenylethyl]amino]methylidene]butanoate

Systemtic Name: ethyl (2Z,3S)-3-methyl-4-nitro-2-[phenyl-[[(1R)-1-phenylethyl]amino]methylidene]butanoate Openeye Name: ethyl (2Z,3S)-3-methyl-4-nitro-2-[phenyl-[[(1R)-1-phenylethyl]amino]methylene]butanoate CAS Name: (2Z,3S)-3-methyl-4-nitro-2-[phenyl-[[(1R)-1-phenylethyl]amino]methylidene]butanoic acid ethyl ester IUPAC Name: ethyl (2Z,3S)-3-methyl-4-nitro-2-[phenyl-[[(1R)-1-phenylethyl]amino]methylidene]butanoate Traditional Name: (Z)-2-[(1S)-1-methyl-2-nitro-ethyl]-3-phenyl-3-[[(1R)-1-phenylethyl]amino]acrylic acid ethyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O4/c1-4-28-22(25)20(16(2)15-24(26)27)21(19-13-9-6-10-14-19)23-17(3)18-11-7-5-8-12-18/h5-14,16-17,23H,4,15H2,1-3H3/b21-20-/t16-,17-/m1/s1