(2S)-2-(6-methoxynaphthalen-2-yl)-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]propanamide

Systemtic Name: (2S)-2-(6-methoxynaphthalen-2-yl)-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]propanamide Openeye Name: (2S)-2-(6-methoxy-2-naphthyl)-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]propanamide CAS Name: (2S)-2-(6-methoxy-2-naphthalenyl)-N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]propanamide IUPAC Name: (2S)-2-(6-methoxynaphthalen-2-yl)-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]propanamide Traditional Name: (2S)-2-(6-methoxy-2-naphthyl)-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]propionamide Formula: C26H32N3O2+ MolecularWeight: 418.55118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)NCC[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)NCC[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H31N3O2/c1-20(21-8-9-23-19-25(31-2)11-10-22(23)18-21)26(30)27-12-13-28-14-16-29(17-15-28)24-6-4-3-5-7-24/h3-11,18-20H,12-17H2,1-2H3,(H,27,30)/p+1/t20-/m0/s1