4-(methylamino)-3-nitro-N-prop-2-enyl-benzamide

Systemtic Name: 4-(methylamino)-3-nitro-N-prop-2-enyl-benzamide Openeye Name: N-allyl-4-(methylamino)-3-nitro-benzamide CAS Name: 4-(methylamino)-3-nitro-N-prop-2-enylbenzamide IUPAC Name: 4-(methylamino)-3-nitro-N-prop-2-enylbenzamide Traditional Name: N-allyl-4-(methylamino)-3-nitro-benzamide Formula: C11H13N3O3 MolecularWeight: 235.23922

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NCC=C)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NCC=C)[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O3/c1-3-6-13-11(15)8-4-5-9(12-2)10(7-8)14(16)17/h3-5,7,12H,1,6H2,2H3,(H,13,15)