1-azanylethylideneazanium benzoate

Systemtic Name: 1-azanylethylideneazanium benzoate Openeye Name: 1-aminoethylideneammonium benzoate CAS Name: 1-aminoethylideneammonium benzoate IUPAC Name: 1-aminoethylideneazanium benzoate Traditional Name: 1-aminoethylideneammonium benzoate Formula: C9H12N2O2 MolecularWeight: 180.20378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H6O2.C2H6N2/c8-7(9)6-4-2-1-3-5-6;1-2(3)4/h1-5H,(H,8,9);1H3,(H3,3,4)