N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-N-methyl-1-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-N-methyl-1-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-N-methyl-1-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-[[4-[(cyclopropylamino)-oxomethyl]phenyl]methyl]-N-methyl-1-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-N-methyl-1-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-[4-(cyclopropylcarbamoyl)benzyl]-N-methyl-1-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C22H21N5O4 MolecularWeight: 419.43324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)NC2CC2)C(=O)C3=NN(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)NC2CC2)C(=O)C3=NN(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O4/c1-25(14-15-5-7-16(8-6-15)21(28)23-17-9-10-17)22(29)20-11-12-26(24-20)18-3-2-4-19(13-18)27(30)31/h2-8,11-13,17H,9-10,14H2,1H3,(H,23,28)