N-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-1-(2,3,4-trimethoxyphenyl)methanimine

Systemtic Name: N-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-1-(2,3,4-trimethoxyphenyl)methanimine Openeye Name: N-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-1-(2,3,4-trimethoxyphenyl)methanimine CAS Name: N-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-1-(2,3,4-trimethoxyphenyl)methanimine IUPAC Name: N-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-1-(2,3,4-trimethoxyphenyl)methanimine Traditional Name: (Z)-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-(2,3,4-trimethoxybenzylidene)amine Formula: C25H30N3O3+ MolecularWeight: 420.524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C=NN2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)/C=N\N2CC[NH+](CC2)CC3=CC=CC4=CC=CC=C43)OC)OC

InChI

InChI=1S/C25H29N3O3/c1-29-23-12-11-20(24(30-2)25(23)31-3)17-26-28-15-13-27(14-16-28)18-21-9-6-8-19-7-4-5-10-22(19)21/h4-12,17H,13-16,18H2,1-3H3/p+1/b26-17-