3-[[1-[2-[(4-acetamidophenyl)carbonylamino]-3-methyl-butanoyl]pyrrolidin-2-yl]carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[[1-[2-[(4-acetamidophenyl)carbonylamino]-3-methyl-butanoyl]pyrrolidin-2-yl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[1-[2-[(4-acetamidobenzoyl)amino]-3-methyl-butanoyl]pyrrolidine-2-carbonyl]amino]-4-oxo-butanoic acid CAS Name: 3-[[[1-[2-[[(4-acetamidophenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]-2-pyrrolidinyl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 3-[[1-[2-[(4-acetamidobenzoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]-4-oxobutanoic acid Traditional Name: 3-[[1-[2-[(4-acetamidobenzoyl)amino]-3-methyl-butanoyl]prolyl]amino]-4-keto-butyric acid Formula: C23H30N4O7 MolecularWeight: 474.5069

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCC1C(=O)NC(CC(=O)O)C=O)NC(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC(C)C(C(=O)N1CCCC1C(=O)NC(CC(=O)O)C=O)NC(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C23H30N4O7/c1-13(2)20(26-21(32)15-6-8-16(9-7-15)24-14(3)29)23(34)27-10-4-5-18(27)22(33)25-17(12-28)11-19(30)31/h6-9,12-13,17-18,20H,4-5,10-11H2,1-3H3,(H,24,29)(H,25,33)(H,26,32)(H,30,31)