[4-[bis(4-aminophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]azanium ethanoate

Systemtic Name: [4-[bis(4-aminophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]azanium ethanoate Openeye Name: [4-[bis(4-aminophenyl)methylene]cyclohexa-2,5-dien-1-ylidene]ammonium acetate CAS Name: [4-[bis(4-aminophenyl)methylidene]-1-cyclohexa-2,5-dienylidene]ammonium acetate IUPAC Name: [4-[bis(4-aminophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]azanium acetate Traditional Name: [4-[bis(4-aminophenyl)methylene]cyclohexa-2,5-dien-1-ylidene]ammonium acetate Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].C1=CC(=[NH2+])C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N

Isomeric SMILES

CC(=O)[O-].C1=CC(=[NH2+])C=CC1=C(C2=CC=C(C=C2)N)C3=CC=C(C=C3)N

InChI

InChI=1S/C19H17N3.C2H4O2/c20-16-7-1-13(2-8-16)19(14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15;1-2(3)4/h1-12,20H,21-22H2;1H3,(H,3,4)