3,4-bis[cyclopropyl-[(4-phenoxyphenyl)methyl]carbamoyl]cyclobutane-1,2-dicarboxylic acid

Systemtic Name: 3,4-bis[cyclopropyl-[(4-phenoxyphenyl)methyl]carbamoyl]cyclobutane-1,2-dicarboxylic acid Openeye Name: 3,4-bis[cyclopropyl-[(4-phenoxyphenyl)methyl]carbamoyl]cyclobutane-1,2-dicarboxylic acid CAS Name: 3,4-bis[[cyclopropyl-[(4-phenoxyphenyl)methyl]amino]-oxomethyl]cyclobutane-1,2-dicarboxylic acid IUPAC Name: 3,4-bis[cyclopropyl-[(4-phenoxyphenyl)methyl]carbamoyl]cyclobutane-1,2-dicarboxylic acid Traditional Name: 3,4-bis[cyclopropyl-(4-phenoxybenzyl)carbamoyl]cyclobutane-1,2-dicarboxylic acid Formula: C40H38N2O8 MolecularWeight: 674.73832

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)C4C(C(C4C(=O)O)C(=O)O)C(=O)N(CC5=CC=C(C=C5)OC6=CC=CC=C6)C7CC7

Isomeric SMILES

C1CC1N(CC2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)C4C(C(C4C(=O)O)C(=O)O)C(=O)N(CC5=CC=C(C=C5)OC6=CC=CC=C6)C7CC7

InChI

InChI=1S/C40H38N2O8/c43-37(41(27-15-16-27)23-25-11-19-31(20-12-25)49-29-7-3-1-4-8-29)33-34(36(40(47)48)35(33)39(45)46)38(44)42(28-17-18-28)24-26-13-21-32(22-14-26)50-30-9-5-2-6-10-30/h1-14,19-22,27-28,33-36H,15-18,23-24H2,(H,45,46)(H,47,48)