[(3S,4S,5R,6S)-4,7-dimethyl-3,5-bis(phenylcarbamoyloxy)-7-(phenylmethoxymethyl)-6-bicyclo[4.1.0]heptanyl] ethanoate

Systemtic Name: [(3S,4S,5R,6S)-4,7-dimethyl-3,5-bis(phenylcarbamoyloxy)-7-(phenylmethoxymethyl)-6-bicyclo[4.1.0]heptanyl] ethanoate Openeye Name: [(1S,2R,3S,4S)-7-(benzyloxymethyl)-3,7-dimethyl-2,4-bis(phenylcarbamoyloxy)norcaran-1-yl] acetate CAS Name: acetic acid [(3S,4S,5R,6S)-3,5-bis[anilino(oxo)methoxy]-4,7-dimethyl-7-(phenylmethoxymethyl)-6-bicyclo[4.1.0]heptanyl] ester IUPAC Name: [(3S,4S,5R,6S)-4,7-dimethyl-3,5-bis(phenylcarbamoyloxy)-7-(phenylmethoxymethyl)-6-bicyclo[4.1.0]heptanyl] acetate Traditional Name: acetic acid [(1S,2R,3S,4S)-7-(benzoxymethyl)-3,7-dimethyl-2,4-bis(phenylcarbamoyloxy)norcaran-1-yl] ester Formula: C33H36N2O7 MolecularWeight: 572.64814

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC2C(C2(C1OC(=O)NC3=CC=CC=C3)OC(=O)C)(C)COCC4=CC=CC=C4)OC(=O)NC5=CC=CC=C5

Isomeric SMILES

C[C@H]1[C@H](CC2[C@@]([C@@H]1OC(=O)NC3=CC=CC=C3)(C2(C)COCC4=CC=CC=C4)OC(=O)C)OC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C33H36N2O7/c1-22-27(40-30(37)34-25-15-9-5-10-16-25)19-28-32(3,21-39-20-24-13-7-4-8-14-24)33(28,42-23(2)36)29(22)41-31(38)35-26-17-11-6-12-18-26/h4-18,22,27-29H,19-21H2,1-3H3,(H,34,37)(H,35,38)/t22-,27-,28?,29+,32?,33+/m0/s1