2-[4-[(4-nitrophenyl)methyl]-1,4-diazepan-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[(4-nitrophenyl)methyl]-1,4-diazepan-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-[(4-nitrophenyl)methyl]-1,4-diazepan-1-yl]acetamide CAS Name: 2-[4-[(4-nitrophenyl)methyl]-1,4-diazepan-1-yl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[(4-nitrophenyl)methyl]-1,4-diazepan-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-(4-nitrobenzyl)-1,4-diazepan-1-yl]acetamide Formula: C17H26N4O3 MolecularWeight: 334.41334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1CCCN(CC1)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)CN1CCCN(CC1)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H26N4O3/c1-14(2)18-17(22)13-20-9-3-8-19(10-11-20)12-15-4-6-16(7-5-15)21(23)24/h4-7,14H,3,8-13H2,1-2H3,(H,18,22)