ethanedioic acid; [8-[3-(propan-2-ylamino)propoxy]-3,4-dihydro-2H-quinolin-1-yl]-pyridin-3-yl-methanone

Systemtic Name: ethanedioic acid; [8-[3-(propan-2-ylamino)propoxy]-3,4-dihydro-2H-quinolin-1-yl]-pyridin-3-yl-methanone Openeye Name: [8-[3-(isopropylamino)propoxy]-3,4-dihydro-2H-quinolin-1-yl]-(3-pyridyl)methanone; oxalic acid CAS Name: oxalic acid; [8-[3-(propan-2-ylamino)propoxy]-3,4-dihydro-2H-quinolin-1-yl]-(3-pyridinyl)methanone IUPAC Name: oxalic acid; [8-[3-(propan-2-ylamino)propoxy]-3,4-dihydro-2H-quinolin-1-yl]-pyridin-3-ylmethanone Traditional Name: [8-[3-(isopropylamino)propoxy]-3,4-dihydro-2H-quinolin-1-yl]-(3-pyridyl)methanone; oxalic acid Formula: C23H29N3O6 MolecularWeight: 443.49286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCCOC1=CC=CC2=C1N(CCC2)C(=O)C3=CN=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)NCCCOC1=CC=CC2=C1N(CCC2)C(=O)C3=CN=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H27N3O2.C2H2O4/c1-16(2)23-12-6-14-26-19-10-3-7-17-9-5-13-24(20(17)19)21(25)18-8-4-11-22-15-18;3-1(4)2(5)6/h3-4,7-8,10-11,15-16,23H,5-6,9,12-14H2,1-2H3;(H,3,4)(H,5,6)