5-isocyanatobenzene-1,3-diamine

Systemtic Name: 5-isocyanatobenzene-1,3-diamine Openeye Name: 5-isocyanatobenzene-1,3-diamine CAS Name: 5-isocyanatobenzene-1,3-diamine IUPAC Name: 5-isocyanatobenzene-1,3-diamine Traditional Name: (3-amino-5-isocyanato-phenyl)amine Formula: C7H7N3O MolecularWeight: 149.14998

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1N)N=C=O)N

Isomeric SMILES

C1=C(C=C(C=C1N)N=C=O)N

InChI

InChI=1S/C7H7N3O/c8-5-1-6(9)3-7(2-5)10-4-11/h1-3H,8-9H2