1-[[[2-(2-cyanophenyl)quinolin-6-yl]methylamino]methyl]cyclopentane-1-carboxylic acid

Systemtic Name: 1-[[[2-(2-cyanophenyl)quinolin-6-yl]methylamino]methyl]cyclopentane-1-carboxylic acid Openeye Name: 1-[[[2-(2-cyanophenyl)-6-quinolyl]methylamino]methyl]cyclopentanecarboxylic acid CAS Name: 1-[[[2-(2-cyanophenyl)-6-quinolinyl]methylamino]methyl]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[[[2-(2-cyanophenyl)quinolin-6-yl]methylamino]methyl]cyclopentane-1-carboxylic acid Traditional Name: 1-[[[2-(2-cyanophenyl)-6-quinolyl]methylamino]methyl]cyclopentanecarboxylic acid Formula: C24H23N3O2 MolecularWeight: 385.45832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(CNCC2=CC3=C(C=C2)N=C(C=C3)C4=CC=CC=C4C#N)C(=O)O

Isomeric SMILES

C1CCC(C1)(CNCC2=CC3=C(C=C2)N=C(C=C3)C4=CC=CC=C4C#N)C(=O)O

InChI

InChI=1S/C24H23N3O2/c25-14-19-5-1-2-6-20(19)22-10-8-18-13-17(7-9-21(18)27-22)15-26-16-24(23(28)29)11-3-4-12-24/h1-2,5-10,13,26H,3-4,11-12,15-16H2,(H,28,29)