1-(2-cyanoethyl)-N,N-diethyl-3-(4-methoxy-3-nitro-phenyl)pyrazole-4-carboxamide

Systemtic Name: 1-(2-cyanoethyl)-N,N-diethyl-3-(4-methoxy-3-nitro-phenyl)pyrazole-4-carboxamide Openeye Name: 1-(2-cyanoethyl)-N,N-diethyl-3-(4-methoxy-3-nitro-phenyl)pyrazole-4-carboxamide CAS Name: 1-(2-cyanoethyl)-N,N-diethyl-3-(4-methoxy-3-nitrophenyl)-4-pyrazolecarboxamide IUPAC Name: 1-(2-cyanoethyl)-N,N-diethyl-3-(4-methoxy-3-nitrophenyl)pyrazole-4-carboxamide Traditional Name: 1-(2-cyanoethyl)-N,N-diethyl-3-(4-methoxy-3-nitro-phenyl)pyrazole-4-carboxamide Formula: C18H21N5O4 MolecularWeight: 371.39044

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CN(N=C1C2=CC(=C(C=C2)OC)[N+](=O)[O-])CCC#N

Isomeric SMILES

CCN(CC)C(=O)C1=CN(N=C1C2=CC(=C(C=C2)OC)[N+](=O)[O-])CCC#N

InChI

InChI=1S/C18H21N5O4/c1-4-21(5-2)18(24)14-12-22(10-6-9-19)20-17(14)13-7-8-16(27-3)15(11-13)23(25)26/h7-8,11-12H,4-6,10H2,1-3H3