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

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl-(thiophen-2-ylmethyl)azanium Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl-(2-thienylmethyl)ammonium CAS Name: (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl-(thiophen-2-ylmethyl)azanium Traditional Name: (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl-(2-thenyl)ammonium Formula: C19H22NO2S+ MolecularWeight: 328.44848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]CC3=CC=CS3)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]CC3=CC=CS3)C(C)C

InChI

InChI=1S/C19H21NO2S/c1-12(2)16-9-17-14(10-20-11-15-5-4-6-23-15)8-19(21)22-18(17)7-13(16)3/h4-9,12,20H,10-11H2,1-3H3/p+1