[2-oxidanylidene-2-[[(1S,5R)-3-(phenylmethyl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]ethyl] 3-(2-methoxy-5-methyl-phenyl)-3-phenyl-propanoate

Systemtic Name: [2-oxidanylidene-2-[[(1S,5R)-3-(phenylmethyl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]ethyl] 3-(2-methoxy-5-methyl-phenyl)-3-phenyl-propanoate Openeye Name: [2-[[(1S,5R)-3-benzyl-3-azabicyclo[3.1.0]hexan-6-yl]amino]-2-oxo-ethyl] 3-(2-methoxy-5-methyl-phenyl)-3-phenyl-propanoate CAS Name: 3-(2-methoxy-5-methylphenyl)-3-phenylpropanoic acid [2-oxo-2-[[(1S,5R)-3-(phenylmethyl)-3-azabicyclo[3.1.0]hexan-6-yl]amino]ethyl] ester IUPAC Name: [2-[[(1S,5R)-3-benzyl-3-azabicyclo[3.1.0]hexan-6-yl]amino]-2-oxoethyl] 3-(2-methoxy-5-methylphenyl)-3-phenylpropanoate Traditional Name: 3-(2-methoxy-5-methyl-phenyl)-3-phenyl-propionic acid [2-[[(1S,5R)-3-benzyl-3-azabicyclo[3.1.0]hexan-6-yl]amino]-2-keto-ethyl] ester Formula: C31H34N2O4 MolecularWeight: 498.61266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(CC(=O)OCC(=O)NC2C3C2CN(C3)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(CC(=O)OCC(=O)NC2[C@H]3[C@@H]2CN(C3)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H34N2O4/c1-21-13-14-28(36-2)25(15-21)24(23-11-7-4-8-12-23)16-30(35)37-20-29(34)32-31-26-18-33(19-27(26)31)17-22-9-5-3-6-10-22/h3-15,24,26-27,31H,16-20H2,1-2H3,(H,32,34)/t24?,26-,27+,31?