ethyl 6-bromanyl-5-[2-[(2,5-dimethylpyrrol-1-yl)amino]-2-oxidanylidene-ethoxy]-2-methyl-1-(phenylmethyl)indole-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-5-[2-[(2,5-dimethylpyrrol-1-yl)amino]-2-oxidanylidene-ethoxy]-2-methyl-1-(phenylmethyl)indole-3-carboxylate Openeye Name: ethyl 1-benzyl-6-bromo-5-[2-[(2,5-dimethylpyrrol-1-yl)amino]-2-oxo-ethoxy]-2-methyl-indole-3-carboxylate CAS Name: 6-bromo-5-[2-[(2,5-dimethyl-1-pyrrolyl)amino]-2-oxoethoxy]-2-methyl-1-(phenylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-6-bromo-5-[2-[(2,5-dimethylpyrrol-1-yl)amino]-2-oxoethoxy]-2-methylindole-3-carboxylate Traditional Name: 1-benzyl-6-bromo-5-[2-[(2,5-dimethylpyrrol-1-yl)amino]-2-keto-ethoxy]-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C27H28BrN3O4 MolecularWeight: 538.43292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OCC(=O)NN3C(=CC=C3C)C)Br)CC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC(=C(C=C21)OCC(=O)NN3C(=CC=C3C)C)Br)CC4=CC=CC=C4)C

InChI

InChI=1S/C27H28BrN3O4/c1-5-34-27(33)26-19(4)30(15-20-9-7-6-8-10-20)23-14-22(28)24(13-21(23)26)35-16-25(32)29-31-17(2)11-12-18(31)3/h6-14H,5,15-16H2,1-4H3,(H,29,32)