2-(1-cyclopentyl-2-oxidanyl-2-oxidanylidene-ethoxy)carbonyl-3,4-bis[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutane-1-carboxylic acid

Systemtic Name: 2-(1-cyclopentyl-2-oxidanyl-2-oxidanylidene-ethoxy)carbonyl-3,4-bis[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutane-1-carboxylic acid Openeye Name: 2-(1-cyclopentyl-2-hydroxy-2-oxo-ethoxy)carbonyl-3,4-bis[(4-phenoxyphenyl)methyl-propyl-carbamoyl]cyclobutanecarboxylic acid CAS Name: 2-[(1-cyclopentyl-2-hydroxy-2-oxoethoxy)-oxomethyl]-3,4-bis[oxo-[(4-phenoxyphenyl)methyl-propylamino]methyl]-1-cyclobutanecarboxylic acid IUPAC Name: 2-(1-cyclopentyl-2-hydroxy-2-oxoethoxy)carbonyl-3,4-bis[(4-phenoxyphenyl)methyl-propylcarbamoyl]cyclobutane-1-carboxylic acid Traditional Name: 2-(1-cyclopentyl-2-hydroxy-2-keto-ethoxy)carbonyl-3,4-bis[(4-phenoxybenzyl)-propyl-carbamoyl]cyclobutanecarboxylic acid Formula: C47H52N2O10 MolecularWeight: 804.92318

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)C3C(C(C3C(=O)O)C(=O)OC(C4CCCC4)C(=O)O)C(=O)N(CCC)CC5=CC=C(C=C5)OC6=CC=CC=C6

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)C3C(C(C3C(=O)O)C(=O)OC(C4CCCC4)C(=O)O)C(=O)N(CCC)CC5=CC=C(C=C5)OC6=CC=CC=C6

InChI

InChI=1S/C47H52N2O10/c1-3-27-48(29-31-19-23-36(24-20-31)57-34-15-7-5-8-16-34)43(50)38-39(41(40(38)45(52)53)47(56)59-42(46(54)55)33-13-11-12-14-33)44(51)49(28-4-2)30-32-21-25-37(26-22-32)58-35-17-9-6-10-18-35/h5-10,15-26,33,38-42H,3-4,11-14,27-30H2,1-2H3,(H,52,53)(H,54,55)