(2S)-N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-naphthalen-1-yl-propanamide

Systemtic Name: (2S)-N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-naphthalen-1-yl-propanamide Openeye Name: (2S)-N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-(1-naphthyl)propanamide CAS Name: (2S)-N-ethyl-2-[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]-N-(1-naphthalenyl)propanamide IUPAC Name: (2S)-N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-naphthalen-1-ylpropanamide Traditional Name: (2S)-N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-(1-naphthyl)propionamide Formula: C26H32N3O2+ MolecularWeight: 418.55118

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC2=CC=CC=C21)C(=O)C(C)[NH+]3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

CCN(C1=CC=CC2=CC=CC=C21)C(=O)[C@H](C)[NH+]3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C26H31N3O2/c1-4-29(25-14-7-10-21-9-5-6-13-24(21)25)26(30)20(2)27-15-17-28(18-16-27)22-11-8-12-23(19-22)31-3/h5-14,19-20H,4,15-18H2,1-3H3/p+1/t20-/m0/s1