N-[(2R)-2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[(2R)-2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[(2R)-2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[(2R)-2-(1-azepanyl)-2-(4-methoxyphenyl)ethyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[(2R)-2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[(2R)-2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-2-(2-nitrophenoxy)acetamide Formula: C23H29N3O5 MolecularWeight: 427.49346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)COC2=CC=CC=C2[N+](=O)[O-])N3CCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)COC2=CC=CC=C2[N+](=O)[O-])N3CCCCCC3

InChI

InChI=1S/C23H29N3O5/c1-30-19-12-10-18(11-13-19)21(25-14-6-2-3-7-15-25)16-24-23(27)17-31-22-9-5-4-8-20(22)26(28)29/h4-5,8-13,21H,2-3,6-7,14-17H2,1H3,(H,24,27)/t21-/m0/s1