1-[1-[2-(cyclohexen-1-yl)ethyl]-2,5-dimethyl-pyrrol-3-yl]-2-(2-nitrophenoxy)ethanone

Systemtic Name: 1-[1-[2-(cyclohexen-1-yl)ethyl]-2,5-dimethyl-pyrrol-3-yl]-2-(2-nitrophenoxy)ethanone Openeye Name: 1-[1-[2-(cyclohexen-1-yl)ethyl]-2,5-dimethyl-pyrrol-3-yl]-2-(2-nitrophenoxy)ethanone CAS Name: 1-[1-[2-(1-cyclohexenyl)ethyl]-2,5-dimethyl-3-pyrrolyl]-2-(2-nitrophenoxy)ethanone IUPAC Name: 1-[1-[2-(cyclohexen-1-yl)ethyl]-2,5-dimethylpyrrol-3-yl]-2-(2-nitrophenoxy)ethanone Traditional Name: 1-[1-[2-(cyclohexen-1-yl)ethyl]-2,5-dimethyl-pyrrol-3-yl]-2-(2-nitrophenoxy)ethanone Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CCCCC2)C)C(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1CCC2=CCCCC2)C)C(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H26N2O4/c1-16-14-19(17(2)23(16)13-12-18-8-4-3-5-9-18)21(25)15-28-22-11-7-6-10-20(22)24(26)27/h6-8,10-11,14H,3-5,9,12-13,15H2,1-2H3