5-bromanyl-1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]indole-2,3-dione

Systemtic Name: 5-bromanyl-1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]indole-2,3-dione Openeye Name: 5-bromo-1-[(4-isopentyloxy-3-methoxy-phenyl)methyl]indoline-2,3-dione CAS Name: 5-bromo-1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]indole-2,3-dione IUPAC Name: 5-bromo-1-[[3-methoxy-4-(3-methylbutoxy)phenyl]methyl]indole-2,3-dione Traditional Name: 5-bromo-1-(4-isoamoxy-3-methoxy-benzyl)isatin Formula: C21H22BrNO4 MolecularWeight: 432.30768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)CN2C3=C(C=C(C=C3)Br)C(=O)C2=O)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)CN2C3=C(C=C(C=C3)Br)C(=O)C2=O)OC

InChI

InChI=1S/C21H22BrNO4/c1-13(2)8-9-27-18-7-4-14(10-19(18)26-3)12-23-17-6-5-15(22)11-16(17)20(24)21(23)25/h4-7,10-11,13H,8-9,12H2,1-3H3