(4-nitrophenyl) 2-[(2S)-3-phenyl-2-[[(2R)-2-phenylmethoxypropanoyl]amino]propanoyl]pyrazolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl) 2-[(2S)-3-phenyl-2-[[(2R)-2-phenylmethoxypropanoyl]amino]propanoyl]pyrazolidine-1-carboxylate Openeye Name: (4-nitrophenyl) 2-[(2S)-2-[[(2R)-2-benzyloxypropanoyl]amino]-3-phenyl-propanoyl]pyrazolidine-1-carboxylate CAS Name: 2-[(2S)-1-oxo-2-[[(2R)-1-oxo-2-phenylmethoxypropyl]amino]-3-phenylpropyl]-1-pyrazolidinecarboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-[(2S)-3-phenyl-2-[[(2R)-2-phenylmethoxypropanoyl]amino]propanoyl]pyrazolidine-1-carboxylate Traditional Name: 2-[(2S)-2-[[(2R)-2-benzoxypropanoyl]amino]-3-phenyl-propanoyl]pyrazolidine-1-carboxylic acid (4-nitrophenyl) ester Formula: C29H30N4O7 MolecularWeight: 546.5711

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC1=CC=CC=C1)C(=O)N2CCCN2C(=O)OC3=CC=C(C=C3)[N+](=O)[O-])OCC4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N2CCCN2C(=O)OC3=CC=C(C=C3)[N+](=O)[O-])OCC4=CC=CC=C4

InChI

InChI=1S/C29H30N4O7/c1-21(39-20-23-11-6-3-7-12-23)27(34)30-26(19-22-9-4-2-5-10-22)28(35)31-17-8-18-32(31)29(36)40-25-15-13-24(14-16-25)33(37)38/h2-7,9-16,21,26H,8,17-20H2,1H3,(H,30,34)/t21-,26+/m1/s1