(2E,4E)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]hexa-2,4-dien-1-one

Systemtic Name: (2E,4E)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]hexa-2,4-dien-1-one Openeye Name: (2E,4E)-1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]hexa-2,4-dien-1-one CAS Name: (2E,4E)-1-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-1-hexa-2,4-dienone IUPAC Name: (2E,4E)-1-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]hexa-2,4-dien-1-one Traditional Name: (2E,4E)-1-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]hexa-2,4-dien-1-one Formula: C21H25N2O+ MolecularWeight: 321.436

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)N1CC[NH+](CC1)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O/c1-2-3-4-12-21(24)23-15-13-22(14-16-23)17-19-10-7-9-18-8-5-6-11-20(18)19/h2-12H,13-17H2,1H3/p+1/b3-2+,12-4+