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

Systemtic Name: N-[4-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[4-(1-cyclopropyltetrazol-5-yl)phenyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[4-(1-cyclopropyl-5-tetrazolyl)phenyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[4-(1-cyclopropyltetrazol-5-yl)phenyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[4-(1-cyclopropyltetrazol-5-yl)phenyl]-4-methoxy-3-nitro-benzamide Formula: C18H16N6O4 MolecularWeight: 380.35744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=NN=NN3C4CC4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=NN=NN3C4CC4)[N+](=O)[O-]

InChI

InChI=1S/C18H16N6O4/c1-28-16-9-4-12(10-15(16)24(26)27)18(25)19-13-5-2-11(3-6-13)17-20-21-22-23(17)14-7-8-14/h2-6,9-10,14H,7-8H2,1H3,(H,19,25)