ethanedioic acid; 2-methyl-7-[(3-methylphenoxy)methyl]-4-pyrrolidin-1-yl-quinoline

Systemtic Name: ethanedioic acid; 2-methyl-7-[(3-methylphenoxy)methyl]-4-pyrrolidin-1-yl-quinoline Openeye Name: 2-methyl-7-[(3-methylphenoxy)methyl]-4-pyrrolidin-1-yl-quinoline; oxalic acid CAS Name: 2-methyl-7-[(3-methylphenoxy)methyl]-4-(1-pyrrolidinyl)quinoline; oxalic acid IUPAC Name: 2-methyl-7-[(3-methylphenoxy)methyl]-4-pyrrolidin-1-ylquinoline; oxalic acid Traditional Name: 2-methyl-7-[(3-methylphenoxy)methyl]-4-pyrrolidino-quinoline; oxalic acid Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=CC3=C(C=C2)C(=CC(=N3)C)N4CCCC4.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=CC3=C(C=C2)C(=CC(=N3)C)N4CCCC4.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H24N2O.C2H2O4/c1-16-6-5-7-19(12-16)25-15-18-8-9-20-21(14-18)23-17(2)13-22(20)24-10-3-4-11-24;3-1(4)2(5)6/h5-9,12-14H,3-4,10-11,15H2,1-2H3;(H,3,4)(H,5,6)