(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-[(1S)-2-methyl-1-thiophen-2-yl-propyl]azanium

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-[(1S)-2-methyl-1-thiophen-2-yl-propyl]azanium Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl-[(1S)-2-methyl-1-(2-thienyl)propyl]ammonium CAS Name: (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl-[(1S)-2-methyl-1-thiophen-2-ylpropyl]ammonium IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl-[(1S)-2-methyl-1-thiophen-2-ylpropyl]azanium Traditional Name: (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl-[(1S)-2-methyl-1-(2-thienyl)propyl]ammonium Formula: C19H21ClNO2S+ MolecularWeight: 362.89354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]C(C3=CC=CS3)C(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+][C@H](C3=CC=CS3)C(C)C)Cl

InChI

InChI=1S/C19H20ClNO2S/c1-11(2)19(17-5-4-6-24-17)21-10-13-8-18(22)23-16-7-12(3)15(20)9-14(13)16/h4-9,11,19,21H,10H2,1-3H3/p+1/t19-/m0/s1