(E)-3-[(3-chlorophenyl)amino]-3-(dimethylamino)-2-isocyano-prop-2-enamide

Systemtic Name: (E)-3-[(3-chlorophenyl)amino]-3-(dimethylamino)-2-isocyano-prop-2-enamide Openeye Name: (E)-3-(3-chloroanilino)-3-(dimethylamino)-2-isocyano-prop-2-enamide CAS Name: (E)-3-(3-chloroanilino)-3-(dimethylamino)-2-isocyano-2-propenamide IUPAC Name: (E)-3-(3-chloroanilino)-3-(dimethylamino)-2-isocyanoprop-2-enamide Traditional Name: (E)-3-(3-chloroanilino)-3-(dimethylamino)-2-isocyano-acrylamide Formula: C12H13ClN4O MolecularWeight: 264.71082

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=C(C(=O)N)[N+]#[C-])NC1=CC(=CC=C1)Cl

Isomeric SMILES

CN(C)/C(=C(\C(=O)N)/[N+]#[C-])/NC1=CC(=CC=C1)Cl

InChI

InChI=1S/C12H13ClN4O/c1-15-10(11(14)18)12(17(2)3)16-9-6-4-5-8(13)7-9/h4-7,16H,2-3H3,(H2,14,18)/b12-10+