azepan-1-yl-[1-[2-(methylamino)-5-nitro-phenyl]carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[2-(methylamino)-5-nitro-phenyl]carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[2-(methylamino)-5-nitro-benzoyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[2-(methylamino)-5-nitrophenyl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[2-(methylamino)-5-nitrobenzoyl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[2-(methylamino)-5-nitro-benzoyl]-4-piperidyl]methanone Formula: C20H28N4O4 MolecularWeight: 388.46072

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCC(CC2)C(=O)N3CCCCCC3

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCC(CC2)C(=O)N3CCCCCC3

InChI

InChI=1S/C20H28N4O4/c1-21-18-7-6-16(24(27)28)14-17(18)20(26)23-12-8-15(9-13-23)19(25)22-10-4-2-3-5-11-22/h6-7,14-15,21H,2-5,8-13H2,1H3