(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]azanium

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]azanium Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl-[(R)-(4-ethylphenyl)-(2-thienyl)methyl]ammonium CAS Name: (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]ammonium IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl-[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]azanium Traditional Name: [(R)-(4-ethylphenyl)-(2-thienyl)methyl]-[(2-keto-7,8-dimethyl-chromen-4-yl)methyl]ammonium Formula: C25H26NO2S+ MolecularWeight: 404.54444

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)[NH2+]CC3=CC(=O)OC4=C3C=CC(=C4C)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C2=CC=CS2)[NH2+]CC3=CC(=O)OC4=C3C=CC(=C4C)C

InChI

InChI=1S/C25H25NO2S/c1-4-18-8-10-19(11-9-18)24(22-6-5-13-29-22)26-15-20-14-23(27)28-25-17(3)16(2)7-12-21(20)25/h5-14,24,26H,4,15H2,1-3H3/p+1/t24-/m1/s1