1-(azocan-1-yl)-2-(3-methyl-4-nitro-phenoxy)ethanone

Systemtic Name: 1-(azocan-1-yl)-2-(3-methyl-4-nitro-phenoxy)ethanone Openeye Name: 1-(azocan-1-yl)-2-(3-methyl-4-nitro-phenoxy)ethanone CAS Name: 1-(1-azocanyl)-2-(3-methyl-4-nitrophenoxy)ethanone IUPAC Name: 1-(azocan-1-yl)-2-(3-methyl-4-nitrophenoxy)ethanone Traditional Name: 1-(azocan-1-yl)-2-(3-methyl-4-nitro-phenoxy)ethanone Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)N2CCCCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)N2CCCCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H22N2O4/c1-13-11-14(7-8-15(13)18(20)21)22-12-16(19)17-9-5-3-2-4-6-10-17/h7-8,11H,2-6,9-10,12H2,1H3