(2R)-N-[4-(cyanomethyl)phenyl]-2-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: (2R)-N-[4-(cyanomethyl)phenyl]-2-(4-nitropyrazol-1-yl)propanamide Openeye Name: (2R)-N-[4-(cyanomethyl)phenyl]-2-(4-nitropyrazol-1-yl)propanamide CAS Name: (2R)-N-[4-(cyanomethyl)phenyl]-2-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: (2R)-N-[4-(cyanomethyl)phenyl]-2-(4-nitropyrazol-1-yl)propanamide Traditional Name: (2R)-N-[4-(cyanomethyl)phenyl]-2-(4-nitropyrazol-1-yl)propionamide Formula: C14H13N5O3 MolecularWeight: 299.28472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)CC#N)N2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)CC#N)N2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H13N5O3/c1-10(18-9-13(8-16-18)19(21)22)14(20)17-12-4-2-11(3-5-12)6-7-15/h2-5,8-10H,6H2,1H3,(H,17,20)/t10-/m1/s1