3-azanylideneisoindol-1-amine; 3-chloranylbenzoic acid

Systemtic Name: 3-azanylideneisoindol-1-amine; 3-chloranylbenzoic acid Openeye Name: 3-chlorobenzoic acid; 3-iminoisoindol-1-amine CAS Name: 3-chlorobenzoic acid; 3-imino-1-isoindolamine IUPAC Name: 3-chlorobenzoic acid; 3-iminoisoindol-1-amine Traditional Name: 3-chlorobenzoic acid; (3-iminoisoindol-1-yl)amine Formula: C15H12ClN3O2 MolecularWeight: 301.72768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC2=N)N.C1=CC(=CC(=C1)Cl)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC2=N)N.C1=CC(=CC(=C1)Cl)C(=O)O

InChI

InChI=1S/C8H7N3.C7H5ClO2/c9-7-5-3-1-2-4-6(5)8(10)11-7;8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H3,9,10,11);1-4H,(H,9,10)