6-bromanyl-1-(4-methoxy-3-piperazin-1-yl-phenyl)sulfonyl-3,4-dihydro-2H-quinoline hydrochloride

Systemtic Name: 6-bromanyl-1-(4-methoxy-3-piperazin-1-yl-phenyl)sulfonyl-3,4-dihydro-2H-quinoline hydrochloride Openeye Name: 6-bromo-1-(4-methoxy-3-piperazin-1-yl-phenyl)sulfonyl-3,4-dihydro-2H-quinoline hydrochloride CAS Name: 6-bromo-1-[4-methoxy-3-(1-piperazinyl)phenyl]sulfonyl-3,4-dihydro-2H-quinoline hydrochloride IUPAC Name: 6-bromo-1-(4-methoxy-3-piperazin-1-ylphenyl)sulfonyl-3,4-dihydro-2H-quinoline hydrochloride Traditional Name: 6-bromo-1-(4-methoxy-3-piperazino-phenyl)sulfonyl-3,4-dihydro-2H-quinoline hydrochloride Formula: C20H25BrClN3O3S MolecularWeight: 502.8528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC3=C2C=CC(=C3)Br)N4CCNCC4.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC3=C2C=CC(=C3)Br)N4CCNCC4.Cl

InChI

InChI=1S/C20H24BrN3O3S.ClH/c1-27-20-7-5-17(14-19(20)23-11-8-22-9-12-23)28(25,26)24-10-2-3-15-13-16(21)4-6-18(15)24;/h4-7,13-14,22H,2-3,8-12H2,1H3;1H