5-bromanyl-1-[(2-butoxyphenyl)methyl]-7-methyl-indole-2,3-dione

Systemtic Name: 5-bromanyl-1-[(2-butoxyphenyl)methyl]-7-methyl-indole-2,3-dione Openeye Name: 5-bromo-1-[(2-butoxyphenyl)methyl]-7-methyl-indoline-2,3-dione CAS Name: 5-bromo-1-[(2-butoxyphenyl)methyl]-7-methylindole-2,3-dione IUPAC Name: 5-bromo-1-[(2-butoxyphenyl)methyl]-7-methylindole-2,3-dione Traditional Name: 5-bromo-1-(2-butoxybenzyl)-7-methyl-isatin Formula: C20H20BrNO3 MolecularWeight: 402.2817

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1CN2C3=C(C=C(C=C3C(=O)C2=O)Br)C

Isomeric SMILES

CCCCOC1=CC=CC=C1CN2C3=C(C=C(C=C3C(=O)C2=O)Br)C

InChI

InChI=1S/C20H20BrNO3/c1-3-4-9-25-17-8-6-5-7-14(17)12-22-18-13(2)10-15(21)11-16(18)19(23)20(22)24/h5-8,10-11H,3-4,9,12H2,1-2H3