N-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-1-(3-nitrophenyl)ethanimine

Systemtic Name: N-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-1-(3-nitrophenyl)ethanimine Openeye Name: N-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-1-(3-nitrophenyl)ethanimine CAS Name: N-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-1-(3-nitrophenyl)ethanimine IUPAC Name: N-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-1-(3-nitrophenyl)ethanimine Traditional Name: (E)-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-[1-(3-nitrophenyl)ethylidene]amine Formula: C23H25N4O2+ MolecularWeight: 389.4702

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN1CC[NH+](CC1)CC2=CC=CC3=CC=CC=C32)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C23H24N4O2/c1-18(20-8-5-10-22(16-20)27(28)29)24-26-14-12-25(13-15-26)17-21-9-4-7-19-6-2-3-11-23(19)21/h2-11,16H,12-15,17H2,1H3/p+1/b24-18+