(2S)-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-naphthalen-1-yl-propanamide

Systemtic Name: (2S)-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-naphthalen-1-yl-propanamide Openeye Name: (2S)-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(1-naphthyl)propanamide CAS Name: (2S)-2-[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]-N-(1-naphthalenyl)propanamide IUPAC Name: (2S)-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-naphthalen-1-ylpropanamide Traditional Name: (2S)-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-(1-naphthyl)propionamide Formula: C23H26N3O2+ MolecularWeight: 376.47144

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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=C4O

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC2=CC=CC=C21)[NH+]3CCN(CC3)C4=CC=CC=C4O

InChI

InChI=1S/C23H25N3O2/c1-17(23(28)24-20-10-6-8-18-7-2-3-9-19(18)20)25-13-15-26(16-14-25)21-11-4-5-12-22(21)27/h2-12,17,27H,13-16H2,1H3,(H,24,28)/p+1/t17-/m0/s1