3-(3-nitropyrazol-1-yl)-N-[4-(piperidin-1-ylmethyl)phenyl]propanamide

Systemtic Name: 3-(3-nitropyrazol-1-yl)-N-[4-(piperidin-1-ylmethyl)phenyl]propanamide Openeye Name: 3-(3-nitropyrazol-1-yl)-N-[4-(1-piperidylmethyl)phenyl]propanamide CAS Name: 3-(3-nitro-1-pyrazolyl)-N-[4-(1-piperidinylmethyl)phenyl]propanamide IUPAC Name: 3-(3-nitropyrazol-1-yl)-N-[4-(piperidin-1-ylmethyl)phenyl]propanamide Traditional Name: 3-(3-nitropyrazol-1-yl)-N-[4-(piperidinomethyl)phenyl]propionamide Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)CCN3C=CC(=N3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)CCN3C=CC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O3/c24-18(9-13-22-12-8-17(20-22)23(25)26)19-16-6-4-15(5-7-16)14-21-10-2-1-3-11-21/h4-8,12H,1-3,9-11,13-14H2,(H,19,24)