N-methyl-N-[1-(3-nitrophenyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-4-(1,2,4-triazol-1-yl)benzamide Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)C2=CC=C(C=C2)N3C=NC=N3

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)C2=CC=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C18H17N5O3/c1-13(15-4-3-5-17(10-15)23(25)26)21(2)18(24)14-6-8-16(9-7-14)22-12-19-11-20-22/h3-13H,1-2H3