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

Systemtic Name: methyl 3-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]propanoate Openeye Name: methyl 3-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]propanoate CAS Name: 3-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methyl-3-indolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-[(4-bromophenyl)methyl]-5-methoxy-2-methylindol-3-yl]propanoate Traditional Name: 3-[1-(4-bromobenzyl)-5-methoxy-2-methyl-indol-3-yl]propionic acid methyl ester Formula: C21H22BrNO3 MolecularWeight: 416.30828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22BrNO3/c1-14-18(9-11-21(24)26-3)19-12-17(25-2)8-10-20(19)23(14)13-15-4-6-16(22)7-5-15/h4-8,10,12H,9,11,13H2,1-3H3