2-azanyl-N-(4-chloranyl-3-methoxy-1-oxidanylidene-isochromen-7-yl)propanamide hydrochloride

Systemtic Name: 2-azanyl-N-(4-chloranyl-3-methoxy-1-oxidanylidene-isochromen-7-yl)propanamide hydrochloride Openeye Name: 2-amino-N-(4-chloro-3-methoxy-1-oxo-isochromen-7-yl)propanamide hydrochloride CAS Name: 2-amino-N-(4-chloro-3-methoxy-1-oxo-2-benzopyran-7-yl)propanamide hydrochloride IUPAC Name: 2-amino-N-(4-chloro-3-methoxy-1-oxoisochromen-7-yl)propanamide hydrochloride Traditional Name: 2-amino-N-(4-chloro-1-keto-3-methoxy-isochromen-7-yl)propionamide hydrochloride Formula: C13H14Cl2N2O4 MolecularWeight: 333.16726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)C(=C(OC2=O)OC)Cl)N.Cl

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)C(=C(OC2=O)OC)Cl)N.Cl

InChI

InChI=1S/C13H13ClN2O4.ClH/c1-6(15)11(17)16-7-3-4-8-9(5-7)12(18)20-13(19-2)10(8)14;/h3-6H,15H2,1-2H3,(H,16,17);1H