2-[(2-azanyl-3-methyl-butanoyl)amino]-3-(6,7-dimethoxy-2-oxidanylidene-chromen-4-yl)propanoic acid

Systemtic Name: 2-[(2-azanyl-3-methyl-butanoyl)amino]-3-(6,7-dimethoxy-2-oxidanylidene-chromen-4-yl)propanoic acid Openeye Name: 2-[(2-amino-3-methyl-butanoyl)amino]-3-(6,7-dimethoxy-2-oxo-chromen-4-yl)propanoic acid CAS Name: 2-[(2-amino-3-methyl-1-oxobutyl)amino]-3-(6,7-dimethoxy-2-oxo-1-benzopyran-4-yl)propanoic acid IUPAC Name: 2-[(2-amino-3-methylbutanoyl)amino]-3-(6,7-dimethoxy-2-oxochromen-4-yl)propanoic acid Traditional Name: 2-[(2-amino-3-methyl-butanoyl)amino]-3-(2-keto-6,7-dimethoxy-chromen-4-yl)propionic acid Formula: C19H24N2O7 MolecularWeight: 392.40306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC1=CC(=O)OC2=CC(=C(C=C12)OC)OC)C(=O)O)N

Isomeric SMILES

CC(C)C(C(=O)NC(CC1=CC(=O)OC2=CC(=C(C=C12)OC)OC)C(=O)O)N

InChI

InChI=1S/C19H24N2O7/c1-9(2)17(20)18(23)21-12(19(24)25)5-10-6-16(22)28-13-8-15(27-4)14(26-3)7-11(10)13/h6-9,12,17H,5,20H2,1-4H3,(H,21,23)(H,24,25)