N-[3-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]-3-methyl-2-nitro-benzamide

Systemtic Name: N-[3-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]-3-methyl-2-nitro-benzamide Openeye Name: N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]-3-methyl-2-nitro-benzamide CAS Name: N-[3-(1-cyclopropyl-5-tetrazolyl)phenyl]-3-methyl-2-nitrobenzamide IUPAC Name: N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]-3-methyl-2-nitrobenzamide Traditional Name: N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]-3-methyl-2-nitro-benzamide Formula: C18H16N6O3 MolecularWeight: 364.35804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=CC(=C2)C3=NN=NN3C4CC4

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=CC(=C2)C3=NN=NN3C4CC4

InChI

InChI=1S/C18H16N6O3/c1-11-4-2-7-15(16(11)24(26)27)18(25)19-13-6-3-5-12(10-13)17-20-21-22-23(17)14-8-9-14/h2-7,10,14H,8-9H2,1H3,(H,19,25)