(3-phenylpropylamino) 5-chloranyl-2-methyl-8-oxidanyl-quinoline-7-sulfinate

Systemtic Name: (3-phenylpropylamino) 5-chloranyl-2-methyl-8-oxidanyl-quinoline-7-sulfinate Openeye Name: (3-phenylpropylamino) 5-chloro-8-hydroxy-2-methyl-quinoline-7-sulfinate CAS Name: 5-chloro-8-hydroxy-2-methyl-7-quinolinesulfinic acid (3-phenylpropylamino) ester IUPAC Name: (3-phenylpropylamino) 5-chloro-8-hydroxy-2-methylquinoline-7-sulfinate Traditional Name: 5-chloro-8-hydroxy-2-methyl-quinoline-7-sulfinic acid (3-phenylpropylamino) ester Formula: C19H19ClN2O3S MolecularWeight: 390.88376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=CC(=C2C=C1)Cl)S(=O)ONCCCC3=CC=CC=C3)O

Isomeric SMILES

CC1=NC2=C(C(=CC(=C2C=C1)Cl)S(=O)ONCCCC3=CC=CC=C3)O

InChI

InChI=1S/C19H19ClN2O3S/c1-13-9-10-15-16(20)12-17(19(23)18(15)22-13)26(24)25-21-11-5-8-14-6-3-2-4-7-14/h2-4,6-7,9-10,12,21,23H,5,8,11H2,1H3