4-[(7-methyl-[1,3]dioxolo[4,5-g]quinolin-6-yl)sulfanylmethyl]benzoate

Systemtic Name: 4-[(7-methyl-[1,3]dioxolo[4,5-g]quinolin-6-yl)sulfanylmethyl]benzoate Openeye Name: 4-[(7-methyl-[1,3]dioxolo[4,5-g]quinolin-6-yl)sulfanylmethyl]benzoate CAS Name: 4-[[(7-methyl-[1,3]dioxolo[4,5-g]quinolin-6-yl)thio]methyl]benzoate IUPAC Name: 4-[(7-methyl-[1,3]dioxolo[4,5-g]quinolin-6-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(7-methyl-[1,3]dioxolo[4,5-g]quinolin-6-yl)thio]methyl]benzoate Formula: C19H14NO4S- MolecularWeight: 352.38376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=C3C(=CC2=C1)OCO3)SCC4=CC=C(C=C4)C(=O)[O-]

Isomeric SMILES

CC1=C(N=C2C=C3C(=CC2=C1)OCO3)SCC4=CC=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C19H15NO4S/c1-11-6-14-7-16-17(24-10-23-16)8-15(14)20-18(11)25-9-12-2-4-13(5-3-12)19(21)22/h2-8H,9-10H2,1H3,(H,21,22)/p-1