1-[4-[[1-(dimethylamino)cycloheptyl]methylamino]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[[1-(dimethylamino)cycloheptyl]methylamino]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[[1-(dimethylamino)cycloheptyl]methylamino]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[[1-(dimethylamino)cycloheptyl]methylamino]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[[1-(dimethylamino)cycloheptyl]methylamino]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[[1-(dimethylamino)cycloheptyl]methylamino]-3-nitro-phenyl]ethanone Formula: C18H27N3O3 MolecularWeight: 333.42528

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)NCC2(CCCCCC2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)NCC2(CCCCCC2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H27N3O3/c1-14(22)15-8-9-16(17(12-15)21(23)24)19-13-18(20(2)3)10-6-4-5-7-11-18/h8-9,12,19H,4-7,10-11,13H2,1-3H3