3-[(8-methoxy-2-oxidanylidene-chromen-3-yl)carbonylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[(8-methoxy-2-oxidanylidene-chromen-3-yl)carbonylamino]propyl-dimethyl-azanium Openeye Name: 3-[(8-methoxy-2-oxo-chromene-3-carbonyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[(8-methoxy-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[(8-methoxy-2-oxochromene-3-carbonyl)amino]propyl-dimethylazanium Traditional Name: 3-[(2-keto-8-methoxy-chromene-3-carbonyl)amino]propyl-dimethyl-ammonium Formula: C16H21N2O4+ MolecularWeight: 305.34894

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=O)C1=CC2=C(C(=CC=C2)OC)OC1=O

Isomeric SMILES

C[NH+](C)CCCNC(=O)C1=CC2=C(C(=CC=C2)OC)OC1=O

InChI

InChI=1S/C16H20N2O4/c1-18(2)9-5-8-17-15(19)12-10-11-6-4-7-13(21-3)14(11)22-16(12)20/h4,6-7,10H,5,8-9H2,1-3H3,(H,17,19)/p+1