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

Systemtic Name: 4-[carboxymethyl-[5-phenyl-3-(5-phenylthiophen-3-yl)pentan-2-yl]carbamoyl]-1,3-dioxolane-2,2-dicarboxylic acid Openeye Name: 4-[carboxymethyl-[1-methyl-4-phenyl-2-(5-phenyl-3-thienyl)butyl]carbamoyl]-1,3-dioxolane-2,2-dicarboxylic acid CAS Name: 4-[[carboxymethyl-[5-phenyl-3-(5-phenyl-3-thiophenyl)pentan-2-yl]amino]-oxomethyl]-1,3-dioxolane-2,2-dicarboxylic acid IUPAC Name: 4-[carboxymethyl-[5-phenyl-3-(5-phenylthiophen-3-yl)pentan-2-yl]carbamoyl]-1,3-dioxolane-2,2-dicarboxylic acid Traditional Name: 4-[carboxymethyl-[1-methyl-4-phenyl-2-(5-phenyl-3-thienyl)butyl]carbamoyl]-1,3-dioxolane-2,2-dicarboxylic acid Formula: C29H29NO9S MolecularWeight: 567.60686

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C29H29NO9S/c1-18(30(15-25(31)32)26(33)23-16-38-29(39-23,27(34)35)28(36)37)22(13-12-19-8-4-2-5-9-19)21-14-24(40-17-21)20-10-6-3-7-11-20/h2-11,14,17-18,22-23H,12-13,15-16H2,1H3,(H,31,32)(H,34,35)(H,36,37)