methyl 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-2-methyl-pentanoate

Systemtic Name: methyl 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-2-methyl-pentanoate Openeye Name: methyl 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]-2-methyl-pentanoate CAS Name: 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-3-indolyl]-2-methylpentanoic acid methyl ester IUPAC Name: methyl 4-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methylindol-3-yl]-2-methylpentanoate Traditional Name: 4-[1-(4-bromobenzyl)-5-methoxy-2-methyl-indol-3-yl]-2-methyl-valeric acid methyl ester Formula: C24H28BrNO3 MolecularWeight: 458.38802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)OC)C(C)CC(C)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)OC)C(C)CC(C)C(=O)OC

InChI

InChI=1S/C24H28BrNO3/c1-15(12-16(2)24(27)29-5)23-17(3)26(14-18-6-8-19(25)9-7-18)22-11-10-20(28-4)13-21(22)23/h6-11,13,15-16H,12,14H2,1-5H3