ethyl (2S)-2-[5-bromanyl-1-(phenylmethyl)indol-3-yl]-2-oxidanyl-ethanoate

Systemtic Name: ethyl (2S)-2-[5-bromanyl-1-(phenylmethyl)indol-3-yl]-2-oxidanyl-ethanoate Openeye Name: ethyl (2S)-2-(1-benzyl-5-bromo-indol-3-yl)-2-hydroxy-acetate CAS Name: (2S)-2-[5-bromo-1-(phenylmethyl)-3-indolyl]-2-hydroxyacetic acid ethyl ester IUPAC Name: ethyl (2S)-2-(1-benzyl-5-bromoindol-3-yl)-2-hydroxyacetate Traditional Name: (2S)-2-(1-benzyl-5-bromo-indol-3-yl)-2-hydroxy-acetic acid ethyl ester Formula: C19H18BrNO3 MolecularWeight: 388.25512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CN(C2=C1C=C(C=C2)Br)CC3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)[C@H](C1=CN(C2=C1C=C(C=C2)Br)CC3=CC=CC=C3)O

InChI

InChI=1S/C19H18BrNO3/c1-2-24-19(23)18(22)16-12-21(11-13-6-4-3-5-7-13)17-9-8-14(20)10-15(16)17/h3-10,12,18,22H,2,11H2,1H3/t18-/m0/s1