ethyl 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-2-methyl-2-oxidanyl-butanoate

Systemtic Name: ethyl 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-2-methyl-2-oxidanyl-butanoate Openeye Name: ethyl 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-2-hydroxy-2-methyl-butanoate CAS Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-3-indolyl]-2-hydroxy-2-methylbutanoic acid ethyl ester IUPAC Name: ethyl 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methylindol-3-yl]-2-hydroxy-2-methylbutanoate Traditional Name: 4-[1-(4-bromobenzyl)-5-methoxy-2-methyl-indol-3-yl]-2-hydroxy-2-methyl-butyric acid ethyl ester Formula: C24H28BrNO4 MolecularWeight: 474.38742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(CCC1=C(N(C2=C1C=C(C=C2)OC)CC3=CC=C(C=C3)Br)C)O

Isomeric SMILES

CCOC(=O)C(C)(CCC1=C(N(C2=C1C=C(C=C2)OC)CC3=CC=C(C=C3)Br)C)O

InChI

InChI=1S/C24H28BrNO4/c1-5-30-23(27)24(3,28)13-12-20-16(2)26(15-17-6-8-18(25)9-7-17)22-11-10-19(29-4)14-21(20)22/h6-11,14,28H,5,12-13,15H2,1-4H3