[4-[(Z)-C-methyl-N-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]carbonimidoyl]phenyl] ethanoate

Systemtic Name: [4-[(Z)-C-methyl-N-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]carbonimidoyl]phenyl] ethanoate Openeye Name: [4-[(Z)-C-methyl-N-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]carbonimidoyl]phenyl] acetate CAS Name: acetic acid [4-[(1Z)-1-[[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]imino]ethyl]phenyl] ester IUPAC Name: [4-[(Z)-C-methyl-N-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]carbonimidoyl]phenyl] acetate Traditional Name: acetic acid [4-[(Z)-C-methyl-N-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]carbonimidoyl]phenyl] ester Formula: C25H28N3O2+ MolecularWeight: 402.50872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN1CC[NH+](CC1)CC2=CC=CC3=CC=CC=C32)C4=CC=C(C=C4)OC(=O)C

Isomeric SMILES

C/C(=N/N1CC[NH+](CC1)CC2=CC=CC3=CC=CC=C32)/C4=CC=C(C=C4)OC(=O)C

InChI

InChI=1S/C25H27N3O2/c1-19(21-10-12-24(13-11-21)30-20(2)29)26-28-16-14-27(15-17-28)18-23-8-5-7-22-6-3-4-9-25(22)23/h3-13H,14-18H2,1-2H3/p+1/b26-19-