N-[4-(azepan-1-ylcarbonyl)phenyl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[4-(azepan-1-ylcarbonyl)phenyl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[4-(azepane-1-carbonyl)phenyl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[4-[1-azepanyl(oxo)methyl]phenyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[4-(azepane-1-carbonyl)phenyl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[4-(azepane-1-carbonyl)phenyl]-2-(2-nitrophenoxy)acetamide Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5/c25-20(15-29-19-8-4-3-7-18(19)24(27)28)22-17-11-9-16(10-12-17)21(26)23-13-5-1-2-6-14-23/h3-4,7-12H,1-2,5-6,13-15H2,(H,22,25)