6-[[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[[4-(1-pyrrolidin-1-iumylmethyl)anilino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]methylene]cyclohexa-2,4-dien-1-one Formula: C18H21N2O+ MolecularWeight: 281.37214

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)NC=C3C=CC=CC3=O

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)NC=C3C=CC=CC3=O

InChI

InChI=1S/C18H20N2O/c21-18-6-2-1-5-16(18)13-19-17-9-7-15(8-10-17)14-20-11-3-4-12-20/h1-2,5-10,13,19H,3-4,11-12,14H2/p+1