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

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-[(R)-phenyl(thiophen-2-yl)methyl]azanium Openeye Name: (6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl-[(R)-phenyl(2-thienyl)methyl]ammonium CAS Name: (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl-[(R)-phenyl(thiophen-2-yl)methyl]ammonium IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl-[(R)-phenyl(thiophen-2-yl)methyl]azanium Traditional Name: (6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl-[(R)-phenyl(2-thienyl)methyl]ammonium Formula: C23H22NO3S+ MolecularWeight: 392.49068

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]C(C3=CC=CC=C3)C4=CC=CS4)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+][C@H](C3=CC=CC=C3)C4=CC=CS4)O

InChI

InChI=1S/C23H21NO3S/c1-2-15-11-18-17(12-22(26)27-20(18)13-19(15)25)14-24-23(21-9-6-10-28-21)16-7-4-3-5-8-16/h3-13,23-25H,2,14H2,1H3/p+1/t23-/m1/s1