N-cyclohexyl-4-[(3-nitrophenyl)methyl]-1,4-diazepane-1-carboxamide

Systemtic Name: N-cyclohexyl-4-[(3-nitrophenyl)methyl]-1,4-diazepane-1-carboxamide Openeye Name: N-cyclohexyl-4-[(3-nitrophenyl)methyl]-1,4-diazepane-1-carboxamide CAS Name: N-cyclohexyl-4-[(3-nitrophenyl)methyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-cyclohexyl-4-[(3-nitrophenyl)methyl]-1,4-diazepane-1-carboxamide Traditional Name: N-cyclohexyl-4-(3-nitrobenzyl)-1,4-diazepane-1-carboxamide Formula: C19H28N4O3 MolecularWeight: 360.45062

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CCCN(CC2)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CCCN(CC2)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H28N4O3/c24-19(20-17-7-2-1-3-8-17)22-11-5-10-21(12-13-22)15-16-6-4-9-18(14-16)23(25)26/h4,6,9,14,17H,1-3,5,7-8,10-13,15H2,(H,20,24)