2-(4-chlorophenyl)sulfanylethyl-[(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]azanium

Systemtic Name: 2-(4-chlorophenyl)sulfanylethyl-[(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: 2-(4-chlorophenyl)sulfanylethyl-[(7,8-dimethyl-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: 2-[(4-chlorophenyl)thio]ethyl-[(7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: 2-(4-chlorophenyl)sulfanylethyl-[(7,8-dimethyl-2-oxochromen-4-yl)methyl]azanium Traditional Name: 2-[(4-chlorophenyl)thio]ethyl-[(2-keto-7,8-dimethyl-chromen-4-yl)methyl]ammonium Formula: C20H21ClNO2S+ MolecularWeight: 374.90424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH2+]CCSC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH2+]CCSC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C20H20ClNO2S/c1-13-3-8-18-15(11-19(23)24-20(18)14(13)2)12-22-9-10-25-17-6-4-16(21)5-7-17/h3-8,11,22H,9-10,12H2,1-2H3/p+1