ethyl 4-[2-(1H-indol-3-yl)ethylcarbamoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[2-(1H-indol-3-yl)ethylcarbamoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-(1H-indol-3-yl)ethylcarbamoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 4-[[2-(1H-indol-3-yl)ethylamino]-oxomethyl]-1,3,5-trimethyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(1H-indol-3-yl)ethylcarbamoyl]-1,3,5-trimethylpyrrole-2-carboxylate Traditional Name: 4-[2-(1H-indol-3-yl)ethylcarbamoyl]-1,3,5-trimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)NCCC2=CNC3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)NCCC2=CNC3=CC=CC=C32)C

InChI

InChI=1S/C21H25N3O3/c1-5-27-21(26)19-13(2)18(14(3)24(19)4)20(25)22-11-10-15-12-23-17-9-7-6-8-16(15)17/h6-9,12,23H,5,10-11H2,1-4H3,(H,22,25)