5-[carboxymethyl-[3-(3-methoxy-4-phenoxy-phenyl)-5-phenyl-pentan-2-yl]carbamoyl]-1,3-dioxolane-2,2,4-tricarboxylic acid

Systemtic Name: 5-[carboxymethyl-[3-(3-methoxy-4-phenoxy-phenyl)-5-phenyl-pentan-2-yl]carbamoyl]-1,3-dioxolane-2,2,4-tricarboxylic acid Openeye Name: 5-[carboxymethyl-[2-(3-methoxy-4-phenoxy-phenyl)-1-methyl-4-phenyl-butyl]carbamoyl]-1,3-dioxolane-2,2,4-tricarboxylic acid CAS Name: 5-[[carboxymethyl-[3-(3-methoxy-4-phenoxyphenyl)-5-phenylpentan-2-yl]amino]-oxomethyl]-1,3-dioxolane-2,2,4-tricarboxylic acid IUPAC Name: 5-[carboxymethyl-[3-(3-methoxy-4-phenoxyphenyl)-5-phenylpentan-2-yl]carbamoyl]-1,3-dioxolane-2,2,4-tricarboxylic acid Traditional Name: 5-[carboxymethyl-[2-(3-methoxy-4-phenoxy-phenyl)-1-methyl-4-phenyl-butyl]carbamoyl]-1,3-dioxolane-2,2,4-tricarboxylic acid Formula: C33H33NO13 MolecularWeight: 651.61402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCC1=CC=CC=C1)C2=CC(=C(C=C2)OC3=CC=CC=C3)OC)N(CC(=O)O)C(=O)C4C(OC(O4)(C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

CC(C(CCC1=CC=CC=C1)C2=CC(=C(C=C2)OC3=CC=CC=C3)OC)N(CC(=O)O)C(=O)C4C(OC(O4)(C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C33H33NO13/c1-19(34(18-26(35)36)29(37)27-28(30(38)39)47-33(46-27,31(40)41)32(42)43)23(15-13-20-9-5-3-6-10-20)21-14-16-24(25(17-21)44-2)45-22-11-7-4-8-12-22/h3-12,14,16-17,19,23,27-28H,13,15,18H2,1-2H3,(H,35,36)(H,38,39)(H,40,41)(H,42,43)