(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl-methyl-(3-thienylmethyl)ammonium CAS Name: (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl-methyl-(3-thenyl)ammonium Formula: C17H17ClNO2S+ MolecularWeight: 334.84038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH+](C)CC3=CSC=C3)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH+](C)CC3=CSC=C3)Cl

InChI

InChI=1S/C17H16ClNO2S/c1-11-5-16-14(7-15(11)18)13(6-17(20)21-16)9-19(2)8-12-3-4-22-10-12/h3-7,10H,8-9H2,1-2H3/p+1