N-[2-[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[4-[2-(dimethylamino)-2-oxo-ethyl]-1,4-diazepan-1-yl]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[4-[2-(dimethylamino)-2-oxoethyl]-1,4-diazepan-1-yl]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[4-[2-(dimethylamino)-2-oxoethyl]-1,4-diazepan-1-yl]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-[4-[2-(dimethylamino)-2-keto-ethyl]-1,4-diazepan-1-yl]-2-keto-ethyl]-3-nitro-benzamide Formula: C18H25N5O5 MolecularWeight: 391.4216

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1CCCN(CC1)C(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)CN1CCCN(CC1)C(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H25N5O5/c1-20(2)17(25)13-21-7-4-8-22(10-9-21)16(24)12-19-18(26)14-5-3-6-15(11-14)23(27)28/h3,5-6,11H,4,7-10,12-13H2,1-2H3,(H,19,26)