4-[carboxymethyl-[3-(6-phenoxypyridin-3-yl)-5-phenyl-pentan-2-yl]carbamoyl]-1,3-dioxolane-2,2-dicarboxylic acid

Systemtic Name: 4-[carboxymethyl-[3-(6-phenoxypyridin-3-yl)-5-phenyl-pentan-2-yl]carbamoyl]-1,3-dioxolane-2,2-dicarboxylic acid Openeye Name: 4-[carboxymethyl-[1-methyl-2-(6-phenoxy-3-pyridyl)-4-phenyl-butyl]carbamoyl]-1,3-dioxolane-2,2-dicarboxylic acid CAS Name: 4-[[carboxymethyl-[3-(6-phenoxy-3-pyridinyl)-5-phenylpentan-2-yl]amino]-oxomethyl]-1,3-dioxolane-2,2-dicarboxylic acid IUPAC Name: 4-[carboxymethyl-[3-(6-phenoxypyridin-3-yl)-5-phenylpentan-2-yl]carbamoyl]-1,3-dioxolane-2,2-dicarboxylic acid Traditional Name: 4-[carboxymethyl-[1-methyl-2-(6-phenoxy-3-pyridyl)-4-phenyl-butyl]carbamoyl]-1,3-dioxolane-2,2-dicarboxylic acid Formula: C30H30N2O10 MolecularWeight: 578.5666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCC1=CC=CC=C1)C2=CN=C(C=C2)OC3=CC=CC=C3)N(CC(=O)O)C(=O)C4COC(O4)(C(=O)O)C(=O)O

Isomeric SMILES

CC(C(CCC1=CC=CC=C1)C2=CN=C(C=C2)OC3=CC=CC=C3)N(CC(=O)O)C(=O)C4COC(O4)(C(=O)O)C(=O)O

InChI

InChI=1S/C30H30N2O10/c1-19(32(17-26(33)34)27(35)24-18-40-30(42-24,28(36)37)29(38)39)23(14-12-20-8-4-2-5-9-20)21-13-15-25(31-16-21)41-22-10-6-3-7-11-22/h2-11,13,15-16,19,23-24H,12,14,17-18H2,1H3,(H,33,34)(H,36,37)(H,38,39)