1-[(5-bromanylthiophen-2-yl)methyl]-2,3-dimethyl-indole-5-carboxylate

Systemtic Name: 1-[(5-bromanylthiophen-2-yl)methyl]-2,3-dimethyl-indole-5-carboxylate Openeye Name: 1-[(5-bromo-2-thienyl)methyl]-2,3-dimethyl-indole-5-carboxylate CAS Name: 1-[(5-bromo-2-thiophenyl)methyl]-2,3-dimethyl-5-indolecarboxylate IUPAC Name: 1-[(5-bromothiophen-2-yl)methyl]-2,3-dimethylindole-5-carboxylate Traditional Name: 1-[(5-bromo-2-thienyl)methyl]-2,3-dimethyl-indole-5-carboxylate Formula: C16H13BrNO2S- MolecularWeight: 363.24892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)C(=O)[O-])CC3=CC=C(S3)Br)C

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)C(=O)[O-])CC3=CC=C(S3)Br)C

InChI

InChI=1S/C16H14BrNO2S/c1-9-10(2)18(8-12-4-6-15(17)21-12)14-5-3-11(16(19)20)7-13(9)14/h3-7H,8H2,1-2H3,(H,19,20)/p-1