2-(3-azanylpropanoylamino)-3-(6,7-dimethoxy-2-oxidanylidene-chromen-4-yl)propanoic acid

Systemtic Name: 2-(3-azanylpropanoylamino)-3-(6,7-dimethoxy-2-oxidanylidene-chromen-4-yl)propanoic acid Openeye Name: 2-(3-aminopropanoylamino)-3-(6,7-dimethoxy-2-oxo-chromen-4-yl)propanoic acid CAS Name: 2-[(3-amino-1-oxopropyl)amino]-3-(6,7-dimethoxy-2-oxo-1-benzopyran-4-yl)propanoic acid IUPAC Name: 2-(3-aminopropanoylamino)-3-(6,7-dimethoxy-2-oxochromen-4-yl)propanoic acid Traditional Name: 2-(3-aminopropanoylamino)-3-(2-keto-6,7-dimethoxy-chromen-4-yl)propionic acid Formula: C17H20N2O7 MolecularWeight: 364.3499

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=CC(=O)O2)CC(C(=O)O)NC(=O)CCN)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=CC(=O)O2)CC(C(=O)O)NC(=O)CCN)OC

InChI

InChI=1S/C17H20N2O7/c1-24-13-7-10-9(5-11(17(22)23)19-15(20)3-4-18)6-16(21)26-12(10)8-14(13)25-2/h6-8,11H,3-5,18H2,1-2H3,(H,19,20)(H,22,23)