3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]propanamide

Systemtic Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]propanamide Openeye Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]propanamide CAS Name: 3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[1-[3-(1-pyrrolyl)phenyl]ethyl]propanamide IUPAC Name: 3-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]propanamide Traditional Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]propionamide Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NC(C)C2=CC(=CC=C2)N3C=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NC(C)C2=CC(=CC=C2)N3C=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O3/c1-14(17-7-6-8-18(13-17)23-10-4-5-11-23)21-19(26)9-12-24-16(3)20(25(27)28)15(2)22-24/h4-8,10-11,13-14H,9,12H2,1-3H3,(H,21,26)