O1-ethyl O3-methyl (3S,5S)-5-(3-ethylphenyl)-3-(phenylmethoxycarbonylamino)cyclopentene-1,3-dicarboxylate

Systemtic Name: O1-ethyl O3-methyl (3S,5S)-5-(3-ethylphenyl)-3-(phenylmethoxycarbonylamino)cyclopentene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-methyl (3S,5S)-3-(benzyloxycarbonylamino)-5-(3-ethylphenyl)cyclopentene-1,3-dicarboxylate CAS Name: (3S,5S)-5-(3-ethylphenyl)-3-(phenylmethoxycarbonylamino)cyclopentene-1,3-dicarboxylic acid O1-ethyl ester O3-methyl ester IUPAC Name: 1-O-ethyl 3-O-methyl (3S,5S)-5-(3-ethylphenyl)-3-(phenylmethoxycarbonylamino)cyclopentene-1,3-dicarboxylate Traditional Name: (3S,5S)-3-(benzyloxycarbonylamino)-5-(3-ethylphenyl)cyclopentene-1,3-dicarboxylic acid O1-ethyl ester O3-methyl ester Formula: C26H29NO6 MolecularWeight: 451.51156

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1)C2CC(C=C2C(=O)OCC)(C(=O)OC)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC(=C1)[C@@H]2C[C@](C=C2C(=O)OCC)(C(=O)OC)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H29NO6/c1-4-18-12-9-13-20(14-18)21-15-26(24(29)31-3,16-22(21)23(28)32-5-2)27-25(30)33-17-19-10-7-6-8-11-19/h6-14,16,21H,4-5,15,17H2,1-3H3,(H,27,30)/t21-,26-/m0/s1