N-[(3,4-diethoxyphenyl)methyl]-3-(3-nitropyrazol-1-yl)propanamide

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-3-(3-nitropyrazol-1-yl)propanamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-3-(3-nitropyrazol-1-yl)propanamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-3-(3-nitro-1-pyrazolyl)propanamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-3-(3-nitropyrazol-1-yl)propanamide Traditional Name: N-(3,4-diethoxybenzyl)-3-(3-nitropyrazol-1-yl)propionamide Formula: C17H22N4O5 MolecularWeight: 362.38038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)CCN2C=CC(=N2)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)CCN2C=CC(=N2)[N+](=O)[O-])OCC

InChI

InChI=1S/C17H22N4O5/c1-3-25-14-6-5-13(11-15(14)26-4-2)12-18-17(22)8-10-20-9-7-16(19-20)21(23)24/h5-7,9,11H,3-4,8,10,12H2,1-2H3,(H,18,22)