[(1R,3R)-3-[(1S)-2-oxidanylidene-1-(phenylmethoxycarbonylamino)-2-pyrrolidin-1-yl-ethyl]cyclopentyl] 4-nitrobenzoate

Systemtic Name: [(1R,3R)-3-[(1S)-2-oxidanylidene-1-(phenylmethoxycarbonylamino)-2-pyrrolidin-1-yl-ethyl]cyclopentyl] 4-nitrobenzoate Openeye Name: [(1R,3R)-3-[(1S)-1-(benzyloxycarbonylamino)-2-oxo-2-pyrrolidin-1-yl-ethyl]cyclopentyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(1R,3R)-3-[(1S)-2-oxo-1-(phenylmethoxycarbonylamino)-2-(1-pyrrolidinyl)ethyl]cyclopentyl] ester IUPAC Name: [(1R,3R)-3-[(1S)-2-oxo-1-(phenylmethoxycarbonylamino)-2-pyrrolidin-1-ylethyl]cyclopentyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(1R,3R)-3-[(1S)-1-(benzyloxycarbonylamino)-2-keto-2-pyrrolidino-ethyl]cyclopentyl] ester Formula: C26H29N3O7 MolecularWeight: 495.52436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(C2CCC(C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)[C@H]([C@@H]2CC[C@H](C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-])NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O7/c30-24(28-14-4-5-15-28)23(27-26(32)35-17-18-6-2-1-3-7-18)20-10-13-22(16-20)36-25(31)19-8-11-21(12-9-19)29(33)34/h1-3,6-9,11-12,20,22-23H,4-5,10,13-17H2,(H,27,32)/t20-,22-,23+/m1/s1