5-(2-acetamidoethoxy)-2-[(2-methylpropylcarbamoylamino)-(4-phenylphenyl)methyl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(2-acetamidoethoxy)-2-[(2-methylpropylcarbamoylamino)-(4-phenylphenyl)methyl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(2-acetamidoethoxy)-2-[(isobutylcarbamoylamino)-(4-phenylphenyl)methyl]-5-oxo-pentanoic acid CAS Name: 5-(2-acetamidoethoxy)-2-[[[(2-methylpropylamino)-oxomethyl]amino]-(4-phenylphenyl)methyl]-5-oxopentanoic acid IUPAC Name: 5-(2-acetamidoethoxy)-2-[(2-methylpropylcarbamoylamino)-(4-phenylphenyl)methyl]-5-oxopentanoic acid Traditional Name: 5-(2-acetamidoethoxy)-2-[(isobutylcarbamoylamino)-(4-phenylphenyl)methyl]-5-keto-valeric acid Formula: C27H35N3O6 MolecularWeight: 497.5833

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(C1=CC=C(C=C1)C2=CC=CC=C2)C(CCC(=O)OCCNC(=O)C)C(=O)O

Isomeric SMILES

CC(C)CNC(=O)NC(C1=CC=C(C=C1)C2=CC=CC=C2)C(CCC(=O)OCCNC(=O)C)C(=O)O

InChI

InChI=1S/C27H35N3O6/c1-18(2)17-29-27(35)30-25(22-11-9-21(10-12-22)20-7-5-4-6-8-20)23(26(33)34)13-14-24(32)36-16-15-28-19(3)31/h4-12,18,23,25H,13-17H2,1-3H3,(H,28,31)(H,33,34)(H2,29,30,35)