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

Systemtic Name: 2-(azepan-1-yl)-4-methyl-quinoline; ethanedioic acid Openeye Name: 2-(azepan-1-yl)-4-methyl-quinoline; oxalic acid CAS Name: 2-(1-azepanyl)-4-methylquinoline; oxalic acid IUPAC Name: 2-(azepan-1-yl)-4-methylquinoline; oxalic acid Traditional Name: 2-(azepan-1-yl)-4-methyl-quinoline; oxalic acid Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)N3CCCCCC3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)N3CCCCCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H20N2.C2H2O4/c1-13-12-16(18-10-6-2-3-7-11-18)17-15-9-5-4-8-14(13)15;3-1(4)2(5)6/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3;(H,3,4)(H,5,6)