methyl 2-cyclohexyloxy-5-[1-oxidanyl-2-(1-phenylpropan-2-ylamino)ethyl]benzoate

Systemtic Name: methyl 2-cyclohexyloxy-5-[1-oxidanyl-2-(1-phenylpropan-2-ylamino)ethyl]benzoate Openeye Name: methyl 2-(cyclohexoxy)-5-[1-hydroxy-2-[(1-methyl-2-phenyl-ethyl)amino]ethyl]benzoate CAS Name: 2-cyclohexyloxy-5-[1-hydroxy-2-(1-phenylpropan-2-ylamino)ethyl]benzoic acid methyl ester IUPAC Name: methyl 2-cyclohexyloxy-5-[1-hydroxy-2-(1-phenylpropan-2-ylamino)ethyl]benzoate Traditional Name: 2-(cyclohexoxy)-5-[1-hydroxy-2-[(1-methyl-2-phenyl-ethyl)amino]ethyl]benzoic acid methyl ester Formula: C25H33NO4 MolecularWeight: 411.53382

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)NCC(C2=CC(=C(C=C2)OC3CCCCC3)C(=O)OC)O

Isomeric SMILES

CC(CC1=CC=CC=C1)NCC(C2=CC(=C(C=C2)OC3CCCCC3)C(=O)OC)O

InChI

InChI=1S/C25H33NO4/c1-18(15-19-9-5-3-6-10-19)26-17-23(27)20-13-14-24(22(16-20)25(28)29-2)30-21-11-7-4-8-12-21/h3,5-6,9-10,13-14,16,18,21,23,26-27H,4,7-8,11-12,15,17H2,1-2H3