1-(2-methyl-2,3-dihydroindol-1-yl)-2-(4-nitrophenyl)sulfanyl-propan-1-one

Systemtic Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-(4-nitrophenyl)sulfanyl-propan-1-one Openeye Name: 1-(2-methylindolin-1-yl)-2-(4-nitrophenyl)sulfanyl-propan-1-one CAS Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(4-nitrophenyl)thio]-1-propanone IUPAC Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-(4-nitrophenyl)sulfanylpropan-1-one Traditional Name: 1-(2-methylindolin-1-yl)-2-[(4-nitrophenyl)thio]propan-1-one Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)C(C)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)C(C)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O3S/c1-12-11-14-5-3-4-6-17(14)19(12)18(21)13(2)24-16-9-7-15(8-10-16)20(22)23/h3-10,12-13H,11H2,1-2H3