2-[(4-methoxyphenyl)carbonylamino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxy-pentanoic acid; quinoline

Systemtic Name: 2-[(4-methoxyphenyl)carbonylamino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxy-pentanoic acid; quinoline Openeye Name: 2-[(4-methoxybenzoyl)amino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxy-pentanoic acid; quinoline CAS Name: 2-[[(4-methoxyphenyl)-oxomethyl]amino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxypentanoic acid; quinoline IUPAC Name: 2-[(4-methoxybenzoyl)amino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxypentanoic acid; quinoline Traditional Name: 5-(4-methoxyphenyl)sulfonyl-2-(p-anisoylamino)-2-phenoxy-valeric acid; quinoline Formula: C35H34N2O8S MolecularWeight: 642.71806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(CCCS(=O)(=O)C2=CC=C(C=C2)OC)(C(=O)O)OC3=CC=CC=C3.C1=CC=C2C(=C1)C=CC=N2

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(CCCS(=O)(=O)C2=CC=C(C=C2)OC)(C(=O)O)OC3=CC=CC=C3.C1=CC=C2C(=C1)C=CC=N2

InChI

InChI=1S/C26H27NO8S.C9H7N/c1-33-20-11-9-19(10-12-20)24(28)27-26(25(29)30,35-22-7-4-3-5-8-22)17-6-18-36(31,32)23-15-13-21(34-2)14-16-23;1-2-6-9-8(4-1)5-3-7-10-9/h3-5,7-16H,6,17-18H2,1-2H3,(H,27,28)(H,29,30);1-7H