4-[(4-tert-butylphenyl)-[(3-nitrophenyl)carbamoylamino]methyl]-N-(2H-1,2,3,4-tetrazol-5-yl)benzamide

Systemtic Name: 4-[(4-tert-butylphenyl)-[(3-nitrophenyl)carbamoylamino]methyl]-N-(2H-1,2,3,4-tetrazol-5-yl)benzamide Openeye Name: 4-[(4-tert-butylphenyl)-[(3-nitrophenyl)carbamoylamino]methyl]-N-(2H-tetrazol-5-yl)benzamide CAS Name: 4-[(4-tert-butylphenyl)-[[(3-nitroanilino)-oxomethyl]amino]methyl]-N-(2H-tetrazol-5-yl)benzamide IUPAC Name: 4-[(4-tert-butylphenyl)-[(3-nitrophenyl)carbamoylamino]methyl]-N-(2H-tetrazol-5-yl)benzamide Traditional Name: 4-[(4-tert-butylphenyl)-[(3-nitrophenyl)carbamoylamino]methyl]-N-(2H-tetrazol-5-yl)benzamide Formula: C26H26N8O4 MolecularWeight: 514.53584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)C(=O)NC3=NNN=N3)NC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)C(=O)NC3=NNN=N3)NC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H26N8O4/c1-26(2,3)19-13-11-17(12-14-19)22(28-25(36)27-20-5-4-6-21(15-20)34(37)38)16-7-9-18(10-8-16)23(35)29-24-30-32-33-31-24/h4-15,22H,1-3H3,(H2,27,28,36)(H2,29,30,31,32,33,35)