(2S)-N-naphthalen-1-yl-2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-naphthalen-1-yl-2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-(1-naphthyl)-2-[4-(2-pyridyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2S)-N-(1-naphthalenyl)-2-[4-(2-pyridinyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2S)-N-naphthalen-1-yl-2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2S)-N-(1-naphthyl)-2-[4-(2-pyridyl)piperazin-1-ium-1-yl]propionamide Formula: C22H25N4O+ MolecularWeight: 361.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=CC=CC=C21)[NH+]3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC2=CC=CC=C21)[NH+]3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C22H24N4O/c1-17(25-13-15-26(16-14-25)21-11-4-5-12-23-21)22(27)24-20-10-6-8-18-7-2-3-9-19(18)20/h2-12,17H,13-16H2,1H3,(H,24,27)/p+1/t17-/m0/s1