2-[2,4-bis(bromanyl)-5-methoxy-1-(phenylmethyl)indol-3-yl]ethanoic acid

Systemtic Name: 2-[2,4-bis(bromanyl)-5-methoxy-1-(phenylmethyl)indol-3-yl]ethanoic acid Openeye Name: 2-(1-benzyl-2,4-dibromo-5-methoxy-indol-3-yl)acetic acid CAS Name: 2-[2,4-dibromo-5-methoxy-1-(phenylmethyl)-3-indolyl]acetic acid IUPAC Name: 2-(1-benzyl-2,4-dibromo-5-methoxyindol-3-yl)acetic acid Traditional Name: 2-(1-benzyl-2,4-dibromo-5-methoxy-indol-3-yl)acetic acid Formula: C18H15Br2NO3 MolecularWeight: 453.1246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)N(C(=C2CC(=O)O)Br)CC3=CC=CC=C3)Br

Isomeric SMILES

COC1=C(C2=C(C=C1)N(C(=C2CC(=O)O)Br)CC3=CC=CC=C3)Br

InChI

InChI=1S/C18H15Br2NO3/c1-24-14-8-7-13-16(17(14)19)12(9-15(22)23)18(20)21(13)10-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,22,23)