azepan-1-yl-[1-(3-methyl-4-nitro-phenyl)carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(3-methyl-4-nitro-phenyl)carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(3-methyl-4-nitro-benzoyl)-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[(3-methyl-4-nitrophenyl)-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(3-methyl-4-nitrobenzoyl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(3-methyl-4-nitro-benzoyl)-4-piperidyl]methanone Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCC(CC2)C(=O)N3CCCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H27N3O4/c1-15-14-17(6-7-18(15)23(26)27)20(25)22-12-8-16(9-13-22)19(24)21-10-4-2-3-5-11-21/h6-7,14,16H,2-5,8-13H2,1H3