2-(butanoylamino)-2-methyl-4-oxidanylidene-5-(2-oxidanylidenechromen-6-yl)oxy-3-(3-phenylpropylcarbamoyl)pentanoic acid

Systemtic Name: 2-(butanoylamino)-2-methyl-4-oxidanylidene-5-(2-oxidanylidenechromen-6-yl)oxy-3-(3-phenylpropylcarbamoyl)pentanoic acid Openeye Name: 2-(butanoylamino)-2-methyl-4-oxo-5-(2-oxochromen-6-yl)oxy-3-(3-phenylpropylcarbamoyl)pentanoic acid CAS Name: 2-methyl-4-oxo-5-[(2-oxo-1-benzopyran-6-yl)oxy]-2-(1-oxobutylamino)-3-[oxo-(3-phenylpropylamino)methyl]pentanoic acid IUPAC Name: 2-(butanoylamino)-2-methyl-4-oxo-5-(2-oxochromen-6-yl)oxy-3-(3-phenylpropylcarbamoyl)pentanoic acid Traditional Name: 2-butyramido-4-keto-5-(2-ketochromen-6-yl)oxy-2-methyl-3-(3-phenylpropylcarbamoyl)valeric acid Formula: C29H32N2O8 MolecularWeight: 536.57298

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(C)(C(C(=O)COC1=CC2=C(C=C1)OC(=O)C=C2)C(=O)NCCCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCC(=O)NC(C)(C(C(=O)COC1=CC2=C(C=C1)OC(=O)C=C2)C(=O)NCCCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C29H32N2O8/c1-3-8-24(33)31-29(2,28(36)37)26(27(35)30-16-7-11-19-9-5-4-6-10-19)22(32)18-38-21-13-14-23-20(17-21)12-15-25(34)39-23/h4-6,9-10,12-15,17,26H,3,7-8,11,16,18H2,1-2H3,(H,30,35)(H,31,33)(H,36,37)