N-[bis(azanyl)methylidene]-2-methyl-5-nitro-4-prop-2-enyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-methyl-5-nitro-4-prop-2-enyl-benzamide Openeye Name: 4-allyl-N-(diaminomethylene)-2-methyl-5-nitro-benzamide CAS Name: N-(diaminomethylidene)-2-methyl-5-nitro-4-prop-2-enylbenzamide IUPAC Name: N-(diaminomethylidene)-2-methyl-5-nitro-4-prop-2-enylbenzamide Traditional Name: 4-allyl-N-(diaminomethylene)-2-methyl-5-nitro-benzamide Formula: C12H14N4O3 MolecularWeight: 262.26456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])CC=C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)N=C(N)N)[N+](=O)[O-])CC=C

InChI

InChI=1S/C12H14N4O3/c1-3-4-8-5-7(2)9(6-10(8)16(18)19)11(17)15-12(13)14/h3,5-6H,1,4H2,2H3,(H4,13,14,15,17)