N-[4-(azepan-1-yl)phenyl]-2-(3-nitrophenoxy)ethanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-(3-nitrophenoxy)ethanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-(3-nitrophenoxy)acetamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-(3-nitrophenoxy)acetamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-(3-nitrophenoxy)acetamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-(3-nitrophenoxy)acetamide Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O4/c24-20(15-27-19-7-5-6-18(14-19)23(25)26)21-16-8-10-17(11-9-16)22-12-3-1-2-4-13-22/h5-11,14H,1-4,12-13,15H2,(H,21,24)