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

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl-[(1S)-2-methyl-1-thiophen-2-yl-propyl]azanium Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl-[(1S)-2-methyl-1-(2-thienyl)propyl]ammonium CAS Name: (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl-[(1S)-2-methyl-1-thiophen-2-ylpropyl]ammonium IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl-[(1S)-2-methyl-1-thiophen-2-ylpropyl]azanium Traditional Name: (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl-[(1S)-2-methyl-1-(2-thienyl)propyl]ammonium Formula: C22H28NO2S+ MolecularWeight: 370.52822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO2S/c1-13(2)17-11-18-16(10-21(24)25-19(18)9-15(17)5)12-23-22(14(3)4)20-7-6-8-26-20/h6-11,13-14,22-23H,12H2,1-5H3/p+1/t22-/m0/s1