2-(azepan-1-yl)-7-methoxy-4-methyl-quinoline; ethanedioic acid

Systemtic Name: 2-(azepan-1-yl)-7-methoxy-4-methyl-quinoline; ethanedioic acid Openeye Name: 2-(azepan-1-yl)-7-methoxy-4-methyl-quinoline; oxalic acid CAS Name: 2-(1-azepanyl)-7-methoxy-4-methylquinoline; oxalic acid IUPAC Name: 2-(azepan-1-yl)-7-methoxy-4-methylquinoline; oxalic acid Traditional Name: 2-(azepan-1-yl)-7-methoxy-4-methyl-quinoline; oxalic acid Formula: C19H24N2O5 MolecularWeight: 360.40426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC(=C2)OC)N3CCCCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=NC2=C1C=CC(=C2)OC)N3CCCCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H22N2O.C2H2O4/c1-13-11-17(19-9-5-3-4-6-10-19)18-16-12-14(20-2)7-8-15(13)16;3-1(4)2(5)6/h7-8,11-12H,3-6,9-10H2,1-2H3;(H,3,4)(H,5,6)