N-[(3-chlorophenyl)methyl]-3-[1-[(4-oxidanylidene-1H-quinolin-2-yl)methyl]piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-3-[1-[(4-oxidanylidene-1H-quinolin-2-yl)methyl]piperidin-1-ium-4-yl]propanamide Openeye Name: N-[(3-chlorophenyl)methyl]-3-[1-[(4-oxo-1H-quinolin-2-yl)methyl]piperidin-1-ium-4-yl]propanamide CAS Name: N-[(3-chlorophenyl)methyl]-3-[1-[(4-oxo-1H-quinolin-2-yl)methyl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-[(3-chlorophenyl)methyl]-3-[1-[(4-oxo-1H-quinolin-2-yl)methyl]piperidin-1-ium-4-yl]propanamide Traditional Name: N-(3-chlorobenzyl)-3-[1-[(4-keto-1H-quinolin-2-yl)methyl]piperidin-1-ium-4-yl]propionamide Formula: C25H29ClN3O2+ MolecularWeight: 438.96966

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CCC(=O)NCC2=CC(=CC=C2)Cl)CC3=CC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1C[NH+](CCC1CCC(=O)NCC2=CC(=CC=C2)Cl)CC3=CC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C25H28ClN3O2/c26-20-5-3-4-19(14-20)16-27-25(31)9-8-18-10-12-29(13-11-18)17-21-15-24(30)22-6-1-2-7-23(22)28-21/h1-7,14-15,18H,8-13,16-17H2,(H,27,31)(H,28,30)/p+1