2-(3-chlorophenyl)ethyl-[(7-methoxy-2-thiophen-3-yl-quinolin-3-yl)methyl]azanium

Systemtic Name: 2-(3-chlorophenyl)ethyl-[(7-methoxy-2-thiophen-3-yl-quinolin-3-yl)methyl]azanium Openeye Name: 2-(3-chlorophenyl)ethyl-[[7-methoxy-2-(3-thienyl)-3-quinolyl]methyl]ammonium CAS Name: 2-(3-chlorophenyl)ethyl-[[7-methoxy-2-(3-thiophenyl)-3-quinolinyl]methyl]ammonium IUPAC Name: 2-(3-chlorophenyl)ethyl-[(7-methoxy-2-thiophen-3-ylquinolin-3-yl)methyl]azanium Traditional Name: 2-(3-chlorophenyl)ethyl-[[7-methoxy-2-(3-thienyl)-3-quinolyl]methyl]ammonium Formula: C23H22ClN2OS+ MolecularWeight: 409.95158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)C[NH2+]CCC3=CC(=CC=C3)Cl)C4=CSC=C4

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)C[NH2+]CCC3=CC(=CC=C3)Cl)C4=CSC=C4

InChI

InChI=1S/C23H21ClN2OS/c1-27-21-6-5-17-12-19(14-25-9-7-16-3-2-4-20(24)11-16)23(26-22(17)13-21)18-8-10-28-15-18/h2-6,8,10-13,15,25H,7,9,14H2,1H3/p+1