2-[methyl-[1-(3-nitrophenyl)ethyl]amino]-N-[(1-phenylpyrazol-4-yl)methyl]ethanamide

Systemtic Name: 2-[methyl-[1-(3-nitrophenyl)ethyl]amino]-N-[(1-phenylpyrazol-4-yl)methyl]ethanamide Openeye Name: 2-[methyl-[1-(3-nitrophenyl)ethyl]amino]-N-[(1-phenylpyrazol-4-yl)methyl]acetamide CAS Name: 2-[methyl-[1-(3-nitrophenyl)ethyl]amino]-N-[(1-phenyl-4-pyrazolyl)methyl]acetamide IUPAC Name: 2-[methyl-[1-(3-nitrophenyl)ethyl]amino]-N-[(1-phenylpyrazol-4-yl)methyl]acetamide Traditional Name: 2-[methyl-[1-(3-nitrophenyl)ethyl]amino]-N-[(1-phenylpyrazol-4-yl)methyl]acetamide Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)CC(=O)NCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)CC(=O)NCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H23N5O3/c1-16(18-7-6-10-20(11-18)26(28)29)24(2)15-21(27)22-12-17-13-23-25(14-17)19-8-4-3-5-9-19/h3-11,13-14,16H,12,15H2,1-2H3,(H,22,27)