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

Systemtic Name: ethyl 5-[2-[(2,5-dimethylpyrrol-1-yl)amino]-2-oxidanylidene-ethoxy]-2-methyl-1-(phenylmethyl)indole-3-carboxylate Openeye Name: ethyl 1-benzyl-5-[2-[(2,5-dimethylpyrrol-1-yl)amino]-2-oxo-ethoxy]-2-methyl-indole-3-carboxylate CAS Name: 5-[2-[(2,5-dimethyl-1-pyrrolyl)amino]-2-oxoethoxy]-2-methyl-1-(phenylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-5-[2-[(2,5-dimethylpyrrol-1-yl)amino]-2-oxoethoxy]-2-methylindole-3-carboxylate Traditional Name: 1-benzyl-5-[2-[(2,5-dimethylpyrrol-1-yl)amino]-2-keto-ethoxy]-2-methyl-indole-3-carboxylic acid ethyl ester Formula: C27H29N3O4 MolecularWeight: 459.53686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)NN3C(=CC=C3C)C)CC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)NN3C(=CC=C3C)C)CC4=CC=CC=C4)C

InChI

InChI=1S/C27H29N3O4/c1-5-33-27(32)26-20(4)29(16-21-9-7-6-8-10-21)24-14-13-22(15-23(24)26)34-17-25(31)28-30-18(2)11-12-19(30)3/h6-15H,5,16-17H2,1-4H3,(H,28,31)