5-bromanyl-2,3,3-trimethyl-1,2-dihydroindole; 2,3,3-trimethyl-5-(3-nitrophenyl)-1,2-dihydroindole

Systemtic Name: 5-bromanyl-2,3,3-trimethyl-1,2-dihydroindole; 2,3,3-trimethyl-5-(3-nitrophenyl)-1,2-dihydroindole Openeye Name: 5-bromo-2,3,3-trimethyl-indoline; 2,3,3-trimethyl-5-(3-nitrophenyl)indoline CAS Name: 5-bromo-2,3,3-trimethyl-1,2-dihydroindole; 2,3,3-trimethyl-5-(3-nitrophenyl)-1,2-dihydroindole IUPAC Name: 5-bromo-2,3,3-trimethyl-1,2-dihydroindole; 2,3,3-trimethyl-5-(3-nitrophenyl)-1,2-dihydroindole Traditional Name: 5-bromo-2,3,3-trimethyl-indoline; 2,3,3-trimethyl-5-(3-nitrophenyl)indoline Formula: C28H32BrN3O2 MolecularWeight: 522.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=C(N1)C=CC(=C2)C3=CC(=CC=C3)[N+](=O)[O-])(C)C.CC1C(C2=C(N1)C=CC(=C2)Br)(C)C

Isomeric SMILES

CC1C(C2=C(N1)C=CC(=C2)C3=CC(=CC=C3)[N+](=O)[O-])(C)C.CC1C(C2=C(N1)C=CC(=C2)Br)(C)C

InChI

InChI=1S/C17H18N2O2.C11H14BrN/c1-11-17(2,3)15-10-13(7-8-16(15)18-11)12-5-4-6-14(9-12)19(20)21;1-7-11(2,3)9-6-8(12)4-5-10(9)13-7/h4-11,18H,1-3H3;4-7,13H,1-3H3