(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-[(R)-phenyl(thiophen-2-yl)methyl]azanium

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl-[(R)-phenyl(thiophen-2-yl)methyl]azanium Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl-[(R)-phenyl(2-thienyl)methyl]ammonium CAS Name: (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl-[(R)-phenyl(thiophen-2-yl)methyl]ammonium IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl-[(R)-phenyl(thiophen-2-yl)methyl]azanium Traditional Name: (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl-[(R)-phenyl(2-thienyl)methyl]ammonium Formula: C22H19ClNO2S+ MolecularWeight: 396.90976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]C(C3=CC=CC=C3)C4=CC=CS4)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+][C@H](C3=CC=CC=C3)C4=CC=CS4)Cl

InChI

InChI=1S/C22H18ClNO2S/c1-14-10-19-17(12-18(14)23)16(11-21(25)26-19)13-24-22(20-8-5-9-27-20)15-6-3-2-4-7-15/h2-12,22,24H,13H2,1H3/p+1/t22-/m1/s1