N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-[(4-nitrophenyl)amino]butanamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-[(4-nitrophenyl)amino]butanamide Openeye Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-(4-nitroanilino)butanamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-4-(4-nitroanilino)butanamide IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-(4-nitroanilino)butanamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-(4-nitroanilino)butyramide Formula: C18H25N5O3 MolecularWeight: 359.4228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C18H25N5O3/c1-14-13-15(2)22(21-14)12-4-11-20-18(24)5-3-10-19-16-6-8-17(9-7-16)23(25)26/h6-9,13,19H,3-5,10-12H2,1-2H3,(H,20,24)