1-[1-(2-diethylaminoethyl)pyrazol-4-yl]-3-(3-nitrophenyl)urea

Systemtic Name: 1-[1-(2-diethylaminoethyl)pyrazol-4-yl]-3-(3-nitrophenyl)urea Openeye Name: 1-[1-(2-diethylaminoethyl)pyrazol-4-yl]-3-(3-nitrophenyl)urea CAS Name: 1-[1-(2-diethylaminoethyl)-4-pyrazolyl]-3-(3-nitrophenyl)urea IUPAC Name: 1-[1-(2-diethylaminoethyl)pyrazol-4-yl]-3-(3-nitrophenyl)urea Traditional Name: 1-[1-(2-diethylaminoethyl)pyrazol-4-yl]-3-(3-nitrophenyl)urea Formula: C16H22N6O3 MolecularWeight: 346.38428

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C=C(C=N1)NC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCN1C=C(C=N1)NC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H22N6O3/c1-3-20(4-2)8-9-21-12-14(11-17-21)19-16(23)18-13-6-5-7-15(10-13)22(24)25/h5-7,10-12H,3-4,8-9H2,1-2H3,(H2,18,19,23)