N-[(E)-2-cyano-3-(2,4-dichlorophenyl)prop-2-enoyl]-3-nitro-pyrazole-1-carboxamide

Systemtic Name: N-[(E)-2-cyano-3-(2,4-dichlorophenyl)prop-2-enoyl]-3-nitro-pyrazole-1-carboxamide Openeye Name: N-[(E)-2-cyano-3-(2,4-dichlorophenyl)prop-2-enoyl]-3-nitro-pyrazole-1-carboxamide CAS Name: N-[(E)-2-cyano-3-(2,4-dichlorophenyl)-1-oxoprop-2-enyl]-3-nitro-1-pyrazolecarboxamide IUPAC Name: N-[(E)-2-cyano-3-(2,4-dichlorophenyl)prop-2-enoyl]-3-nitropyrazole-1-carboxamide Traditional Name: N-[(E)-2-cyano-3-(2,4-dichlorophenyl)acryloyl]-3-nitro-pyrazole-1-carboxamide Formula: C14H7Cl2N5O4 MolecularWeight: 380.14248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)C=C(C#N)C(=O)NC(=O)N2C=CC(=N2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)/C=C(\C#N)/C(=O)NC(=O)N2C=CC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H7Cl2N5O4/c15-10-2-1-8(11(16)6-10)5-9(7-17)13(22)18-14(23)20-4-3-12(19-20)21(24)25/h1-6H,(H,18,22,23)/b9-5+