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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1CN2C3=C(C=C(C=C3)Br)C(=O)C2=O

Isomeric SMILES

CCCCCOC1=CC=CC=C1CN2C3=C(C=C(C=C3)Br)C(=O)C2=O

InChI

InChI=1S/C20H20BrNO3/c1-2-3-6-11-25-18-8-5-4-7-14(18)13-22-17-10-9-15(21)12-16(17)19(23)20(22)24/h4-5,7-10,12H,2-3,6,11,13H2,1H3