2-[4,4-bis(4-methoxyphenyl)pentanoylamino]-5-methyl-benzoic acid

Systemtic Name: 2-[4,4-bis(4-methoxyphenyl)pentanoylamino]-5-methyl-benzoic acid Openeye Name: 2-[4,4-bis(4-methoxyphenyl)pentanoylamino]-5-methyl-benzoic acid CAS Name: 2-[[4,4-bis(4-methoxyphenyl)-1-oxopentyl]amino]-5-methylbenzoic acid IUPAC Name: 2-[4,4-bis(4-methoxyphenyl)pentanoylamino]-5-methylbenzoic acid Traditional Name: 2-[4,4-bis(4-methoxyphenyl)pentanoylamino]-5-methyl-benzoic acid Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCC(C)(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCC(C)(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC)C(=O)O

InChI

InChI=1S/C27H29NO5/c1-18-5-14-24(23(17-18)26(30)31)28-25(29)15-16-27(2,19-6-10-21(32-3)11-7-19)20-8-12-22(33-4)13-9-20/h5-14,17H,15-16H2,1-4H3,(H,28,29)(H,30,31)