phenyl (2S,3R)-3-(3-cyclopentyloxy-4-methoxy-phenyl)-2-[(phenoxycarbonylamino)methyl]pyrrolidine-1-carboxylate

Systemtic Name: phenyl (2S,3R)-3-(3-cyclopentyloxy-4-methoxy-phenyl)-2-[(phenoxycarbonylamino)methyl]pyrrolidine-1-carboxylate Openeye Name: phenyl (2S,3R)-3-[3-(cyclopentoxy)-4-methoxy-phenyl]-2-[(phenoxycarbonylamino)methyl]pyrrolidine-1-carboxylate CAS Name: (2S,3R)-3-(3-cyclopentyloxy-4-methoxyphenyl)-2-[[[oxo(phenoxy)methyl]amino]methyl]-1-pyrrolidinecarboxylic acid phenyl ester IUPAC Name: phenyl (2S,3R)-3-(3-cyclopentyloxy-4-methoxyphenyl)-2-[(phenoxycarbonylamino)methyl]pyrrolidine-1-carboxylate Traditional Name: (2S,3R)-2-[(carbophenoxyamino)methyl]-3-[3-(cyclopentoxy)-4-methoxy-phenyl]pyrrolidine-1-carboxylic acid phenyl ester Formula: C31H34N2O6 MolecularWeight: 530.61146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCN(C2CNC(=O)OC3=CC=CC=C3)C(=O)OC4=CC=CC=C4)OC5CCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H]2CCN([C@@H]2CNC(=O)OC3=CC=CC=C3)C(=O)OC4=CC=CC=C4)OC5CCCC5

InChI

InChI=1S/C31H34N2O6/c1-36-28-17-16-22(20-29(28)37-23-14-8-9-15-23)26-18-19-33(31(35)39-25-12-6-3-7-13-25)27(26)21-32-30(34)38-24-10-4-2-5-11-24/h2-7,10-13,16-17,20,23,26-27H,8-9,14-15,18-19,21H2,1H3,(H,32,34)/t26-,27-/m1/s1