[2-(4-aminophenyl)ethylamino] 5-chloranyl-2-methyl-8-oxidanyl-quinoline-7-sulfinate

Systemtic Name: [2-(4-aminophenyl)ethylamino] 5-chloranyl-2-methyl-8-oxidanyl-quinoline-7-sulfinate Openeye Name: [2-(4-aminophenyl)ethylamino] 5-chloro-8-hydroxy-2-methyl-quinoline-7-sulfinate CAS Name: 5-chloro-8-hydroxy-2-methyl-7-quinolinesulfinic acid [2-(4-aminophenyl)ethylamino] ester IUPAC Name: [2-(4-aminophenyl)ethylamino] 5-chloro-8-hydroxy-2-methylquinoline-7-sulfinate Traditional Name: 5-chloro-8-hydroxy-2-methyl-quinoline-7-sulfinic acid [2-(4-aminophenyl)ethylamino] ester Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=CC(=C2C=C1)Cl)S(=O)ONCCC3=CC=C(C=C3)N)O

Isomeric SMILES

CC1=NC2=C(C(=CC(=C2C=C1)Cl)S(=O)ONCCC3=CC=C(C=C3)N)O

InChI

InChI=1S/C18H18ClN3O3S/c1-11-2-7-14-15(19)10-16(18(23)17(14)22-11)26(24)25-21-9-8-12-3-5-13(20)6-4-12/h2-7,10,21,23H,8-9,20H2,1H3