3-[[1-[3-methyl-2-[(7-methyl-2-phenyl-quinolin-4-yl)carbonylamino]butanoyl]pyrrolidin-2-yl]carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[[1-[3-methyl-2-[(7-methyl-2-phenyl-quinolin-4-yl)carbonylamino]butanoyl]pyrrolidin-2-yl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[1-[3-methyl-2-[(7-methyl-2-phenyl-quinoline-4-carbonyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]-4-oxo-butanoic acid CAS Name: 3-[[[1-[3-methyl-2-[[(7-methyl-2-phenyl-4-quinolinyl)-oxomethyl]amino]-1-oxobutyl]-2-pyrrolidinyl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 3-[[1-[3-methyl-2-[(7-methyl-2-phenylquinoline-4-carbonyl)amino]butanoyl]pyrrolidine-2-carbonyl]amino]-4-oxobutanoic acid Traditional Name: 4-keto-3-[[1-[3-methyl-2-[(7-methyl-2-phenyl-quinoline-4-carbonyl)amino]butanoyl]prolyl]amino]butyric acid Formula: C31H34N4O6 MolecularWeight: 558.62486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC(C(C)C)C(=O)N4CCCC4C(=O)NC(CC(=O)O)C=O

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=N2)C3=CC=CC=C3)C(=O)NC(C(C)C)C(=O)N4CCCC4C(=O)NC(CC(=O)O)C=O

InChI

InChI=1S/C31H34N4O6/c1-18(2)28(31(41)35-13-7-10-26(35)30(40)32-21(17-36)15-27(37)38)34-29(39)23-16-24(20-8-5-4-6-9-20)33-25-14-19(3)11-12-22(23)25/h4-6,8-9,11-12,14,16-18,21,26,28H,7,10,13,15H2,1-3H3,(H,32,40)(H,34,39)(H,37,38)