2-[4-bromanyl-2-methyl-1-(phenylmethyl)indol-3-yl]ethanoic acid

Systemtic Name: 2-[4-bromanyl-2-methyl-1-(phenylmethyl)indol-3-yl]ethanoic acid Openeye Name: 2-(1-benzyl-4-bromo-2-methyl-indol-3-yl)acetic acid CAS Name: 2-[4-bromo-2-methyl-1-(phenylmethyl)-3-indolyl]acetic acid IUPAC Name: 2-(1-benzyl-4-bromo-2-methylindol-3-yl)acetic acid Traditional Name: 2-(1-benzyl-4-bromo-2-methyl-indol-3-yl)acetic acid Formula: C18H16BrNO2 MolecularWeight: 358.22914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2Br)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2Br)CC(=O)O

InChI

InChI=1S/C18H16BrNO2/c1-12-14(10-17(21)22)18-15(19)8-5-9-16(18)20(12)11-13-6-3-2-4-7-13/h2-9H,10-11H2,1H3,(H,21,22)