methyl 4-bromanyl-3-[(4-hydroxyphenyl)methyl]-1-oxidanyl-indole-2-carboxylate

Systemtic Name: methyl 4-bromanyl-3-[(4-hydroxyphenyl)methyl]-1-oxidanyl-indole-2-carboxylate Openeye Name: methyl 4-bromo-1-hydroxy-3-[(4-hydroxyphenyl)methyl]indole-2-carboxylate CAS Name: 4-bromo-1-hydroxy-3-[(4-hydroxyphenyl)methyl]-2-indolecarboxylic acid methyl ester IUPAC Name: methyl 4-bromo-1-hydroxy-3-[(4-hydroxyphenyl)methyl]indole-2-carboxylate Traditional Name: 4-bromo-1-hydroxy-3-(4-hydroxybenzyl)indole-2-carboxylic acid methyl ester Formula: C17H14BrNO4 MolecularWeight: 376.20136

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(N1O)C=CC=C2Br)CC3=CC=C(C=C3)O

Isomeric SMILES

COC(=O)C1=C(C2=C(N1O)C=CC=C2Br)CC3=CC=C(C=C3)O

InChI

InChI=1S/C17H14BrNO4/c1-23-17(21)16-12(9-10-5-7-11(20)8-6-10)15-13(18)3-2-4-14(15)19(16)22/h2-8,20,22H,9H2,1H3