2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-2-(3-phenylazanylcyclohexyl)ethanoic acid

Systemtic Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-2-(3-phenylazanylcyclohexyl)ethanoic acid Openeye Name: 2-(3-anilinocyclohexyl)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]acetic acid CAS Name: 2-(3-anilinocyclohexyl)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]acetic acid IUPAC Name: 2-(3-anilinocyclohexyl)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]acetic acid Traditional Name: 2-(3-anilinocyclohexyl)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]acetic acid Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(C3CCCC(C3)NC4=CC=CC=C4)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(C3CCCC(C3)NC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C27H30N2O5S/c1-34-24-14-10-19(11-15-24)20-12-16-25(17-13-20)35(32,33)29-26(27(30)31)21-6-5-9-23(18-21)28-22-7-3-2-4-8-22/h2-4,7-8,10-17,21,23,26,28-29H,5-6,9,18H2,1H3,(H,30,31)