2-(3-methylphenoxy)-1-(6-nitro-2,3-dihydroindol-1-yl)propan-1-one

Systemtic Name: 2-(3-methylphenoxy)-1-(6-nitro-2,3-dihydroindol-1-yl)propan-1-one Openeye Name: 2-(3-methylphenoxy)-1-(6-nitroindolin-1-yl)propan-1-one CAS Name: 2-(3-methylphenoxy)-1-(6-nitro-2,3-dihydroindol-1-yl)-1-propanone IUPAC Name: 2-(3-methylphenoxy)-1-(6-nitro-2,3-dihydroindol-1-yl)propan-1-one Traditional Name: 2-(3-methylphenoxy)-1-(6-nitroindolin-1-yl)propan-1-one Formula: C18H18N2O4 MolecularWeight: 326.34652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(C)C(=O)N2CCC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OC(C)C(=O)N2CCC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O4/c1-12-4-3-5-16(10-12)24-13(2)18(21)19-9-8-14-6-7-15(20(22)23)11-17(14)19/h3-7,10-11,13H,8-9H2,1-2H3