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

Systemtic Name: 4-azanyl-N-[3-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]-3-nitro-benzamide Openeye Name: 4-amino-N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]-3-nitro-benzamide CAS Name: 4-amino-N-[3-(1-cyclopropyl-5-tetrazolyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-amino-N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]-3-nitrobenzamide Traditional Name: 4-amino-N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]-3-nitro-benzamide Formula: C17H15N7O3 MolecularWeight: 365.3461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C=C4)N)[N+](=O)[O-]

Isomeric SMILES

C1CC1N2C(=NN=N2)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C=C4)N)[N+](=O)[O-]

InChI

InChI=1S/C17H15N7O3/c18-14-7-4-11(9-15(14)24(26)27)17(25)19-12-3-1-2-10(8-12)16-20-21-22-23(16)13-5-6-13/h1-4,7-9,13H,5-6,18H2,(H,19,25)