4-[[[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]amino]methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]amino]methylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 3-hydroxy-4-[[[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]amino]methylene]cyclohexa-2,5-dien-1-one CAS Name: 3-hydroxy-4-[[[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]amino]methylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 3-hydroxy-4-[[[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]amino]methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 3-hydroxy-4-[[[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]amino]methylene]cyclohexa-2,5-dien-1-one Formula: C22H24N3O2+ MolecularWeight: 362.44486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)NC=C4C=CC(=O)C=C4O

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)NC=C4C=CC(=O)C=C4O

InChI

InChI=1S/C22H23N3O2/c26-20-9-8-18(22(27)14-20)15-23-25-12-10-24(11-13-25)16-19-6-3-5-17-4-1-2-7-21(17)19/h1-9,14-15,23,27H,10-13,16H2/p+1