ethyl (Z)-2-[(1S)-2-nitro-1-phenyl-ethyl]-3-[[(1R)-1-phenylethyl]amino]but-2-enoate

Systemtic Name: ethyl (Z)-2-[(1S)-2-nitro-1-phenyl-ethyl]-3-[[(1R)-1-phenylethyl]amino]but-2-enoate Openeye Name: ethyl (Z)-2-[(1S)-2-nitro-1-phenyl-ethyl]-3-[[(1R)-1-phenylethyl]amino]but-2-enoate CAS Name: (Z)-2-[(1S)-2-nitro-1-phenylethyl]-3-[[(1R)-1-phenylethyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-[(1S)-2-nitro-1-phenylethyl]-3-[[(1R)-1-phenylethyl]amino]but-2-enoate Traditional Name: (Z)-2-[(1S)-2-nitro-1-phenyl-ethyl]-3-[[(1R)-1-phenylethyl]amino]but-2-enoic acid ethyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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