N-[4-(6-methyl-4-phenyl-quinolin-2-yl)phenyl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[4-(6-methyl-4-phenyl-quinolin-2-yl)phenyl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[4-(6-methyl-4-phenyl-2-quinolyl)phenyl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[4-(6-methyl-4-phenyl-2-quinolinyl)phenyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[4-(6-methyl-4-phenylquinolin-2-yl)phenyl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[4-(6-methyl-4-phenyl-2-quinolyl)phenyl]-2-piperidin-1-ium-1-yl-acetamide Formula: C29H30N3O+ MolecularWeight: 436.568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C3=CC=CC=C3)C4=CC=C(C=C4)NC(=O)C[NH+]5CCCCC5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C3=CC=CC=C3)C4=CC=C(C=C4)NC(=O)C[NH+]5CCCCC5

InChI

InChI=1S/C29H29N3O/c1-21-10-15-27-26(18-21)25(22-8-4-2-5-9-22)19-28(31-27)23-11-13-24(14-12-23)30-29(33)20-32-16-6-3-7-17-32/h2,4-5,8-15,18-19H,3,6-7,16-17,20H2,1H3,(H,30,33)/p+1