(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-(thiophen-2-ylmethyl)azanium Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl-(2-thienylmethyl)ammonium CAS Name: (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl-(thiophen-2-ylmethyl)azanium Traditional Name: (2-keto-6,7-dimethyl-chromen-4-yl)methyl-(2-thenyl)ammonium Formula: C17H18NO2S+ MolecularWeight: 300.39532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]CC3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]CC3=CC=CS3)C

InChI

InChI=1S/C17H17NO2S/c1-11-6-15-13(9-18-10-14-4-3-5-21-14)8-17(19)20-16(15)7-12(11)2/h3-8,18H,9-10H2,1-2H3/p+1