methyl (2S)-2-[(4-nitrophenyl)methylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(4-nitrophenyl)methylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(4-nitrophenyl)methylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[(4-nitrophenyl)methylamino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(4-nitrophenyl)methylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[(4-nitrobenzyl)amino]-3-phenyl-propionic acid methyl ester Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O4/c1-23-17(20)16(11-13-5-3-2-4-6-13)18-12-14-7-9-15(10-8-14)19(21)22/h2-10,16,18H,11-12H2,1H3/t16-/m0/s1