3-methyl-2-[2-[4-[4-(2-methylcyclohexyl)oxyphenoxy]phenyl]ethanoylamino]benzoic acid

Systemtic Name: 3-methyl-2-[2-[4-[4-(2-methylcyclohexyl)oxyphenoxy]phenyl]ethanoylamino]benzoic acid Openeye Name: 3-methyl-2-[[2-[4-[4-(2-methylcyclohexoxy)phenoxy]phenyl]acetyl]amino]benzoic acid CAS Name: 3-methyl-2-[[2-[4-[4-(2-methylcyclohexyl)oxyphenoxy]phenyl]-1-oxoethyl]amino]benzoic acid IUPAC Name: 3-methyl-2-[[2-[4-[4-(2-methylcyclohexyl)oxyphenoxy]phenyl]acetyl]amino]benzoic acid Traditional Name: 3-methyl-2-[[2-[4-[4-(2-methylcyclohexoxy)phenoxy]phenyl]acetyl]amino]benzoic acid Formula: C29H31NO5 MolecularWeight: 473.56014

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1OC2=CC=C(C=C2)OC3=CC=C(C=C3)CC(=O)NC4=C(C=CC=C4C)C(=O)O

Isomeric SMILES

CC1CCCCC1OC2=CC=C(C=C2)OC3=CC=C(C=C3)CC(=O)NC4=C(C=CC=C4C)C(=O)O

InChI

InChI=1S/C29H31NO5/c1-19-6-3-4-9-26(19)35-24-16-14-23(15-17-24)34-22-12-10-21(11-13-22)18-27(31)30-28-20(2)7-5-8-25(28)29(32)33/h5,7-8,10-17,19,26H,3-4,6,9,18H2,1-2H3,(H,30,31)(H,32,33)