ethyl 1,2,5-trimethyl-4-(3-phenylpyrrolidin-1-yl)sulfonyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1,2,5-trimethyl-4-(3-phenylpyrrolidin-1-yl)sulfonyl-pyrrole-3-carboxylate Openeye Name: ethyl 1,2,5-trimethyl-4-(3-phenylpyrrolidin-1-yl)sulfonyl-pyrrole-3-carboxylate CAS Name: 1,2,5-trimethyl-4-[(3-phenyl-1-pyrrolidinyl)sulfonyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1,2,5-trimethyl-4-(3-phenylpyrrolidin-1-yl)sulfonylpyrrole-3-carboxylate Traditional Name: 1,2,5-trimethyl-4-(3-phenylpyrrolidino)sulfonyl-pyrrole-3-carboxylic acid ethyl ester Formula: C20H26N2O4S MolecularWeight: 390.49644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCC(C2)C3=CC=CC=C3)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCC(C2)C3=CC=CC=C3)C)C)C

InChI

InChI=1S/C20H26N2O4S/c1-5-26-20(23)18-14(2)21(4)15(3)19(18)27(24,25)22-12-11-17(13-22)16-9-7-6-8-10-16/h6-10,17H,5,11-13H2,1-4H3