(phenylmethyl) N-(2-azanyl-3-phenyl-propanoyl)-N-(4-nitrophenyl)carbamate

Systemtic Name: (phenylmethyl) N-(2-azanyl-3-phenyl-propanoyl)-N-(4-nitrophenyl)carbamate Openeye Name: benzyl N-(2-amino-3-phenyl-propanoyl)-N-(4-nitrophenyl)carbamate CAS Name: N-(2-amino-1-oxo-3-phenylpropyl)-N-(4-nitrophenyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(2-amino-3-phenylpropanoyl)-N-(4-nitrophenyl)carbamate Traditional Name: N-(4-nitrophenyl)-N-phenylalanyl-carbamic acid benzyl ester Formula: C23H21N3O5 MolecularWeight: 419.42994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)N(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=CC=C3)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)N(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=CC=C3)N

InChI

InChI=1S/C23H21N3O5/c24-21(15-17-7-3-1-4-8-17)22(27)25(19-11-13-20(14-12-19)26(29)30)23(28)31-16-18-9-5-2-6-10-18/h1-14,21H,15-16,24H2