2-(azepan-1-yl)-7-methoxy-4-phenyl-quinolin-1-ium

Systemtic Name: 2-(azepan-1-yl)-7-methoxy-4-phenyl-quinolin-1-ium Openeye Name: 2-(azepan-1-yl)-7-methoxy-4-phenyl-quinolin-1-ium CAS Name: 2-(1-azepanyl)-7-methoxy-4-phenylquinolin-1-ium IUPAC Name: 2-(azepan-1-yl)-7-methoxy-4-phenylquinolin-1-ium Traditional Name: 2-(azepan-1-yl)-7-methoxy-4-phenyl-quinolin-1-ium Formula: C22H25N2O+ MolecularWeight: 333.4467

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=[NH+]2)N3CCCCCC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=[NH+]2)N3CCCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N2O/c1-25-18-11-12-19-20(17-9-5-4-6-10-17)16-22(23-21(19)15-18)24-13-7-2-3-8-14-24/h4-6,9-12,15-16H,2-3,7-8,13-14H2,1H3/p+1