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

Systemtic Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C19H19N5O4 MolecularWeight: 381.38526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCN(C)C(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OCCN(C)C(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O4/c1-14-3-6-16(7-4-14)28-10-9-22(2)19(25)15-5-8-17(18(11-15)24(26)27)23-13-20-12-21-23/h3-8,11-13H,9-10H2,1-2H3