ethyl 4-[[2-(diethylaminomethyl)phenyl]methylcarbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[[2-(diethylaminomethyl)phenyl]methylcarbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[[2-(diethylaminomethyl)phenyl]methylcarbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[[[2-(diethylaminomethyl)phenyl]methylamino]-oxomethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(diethylaminomethyl)phenyl]methylcarbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[[2-(diethylaminomethyl)benzyl]carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=CC=C1CNC(=O)C2=C(NC(=C2C)C(=O)OCC)C

Isomeric SMILES

CCN(CC)CC1=CC=CC=C1CNC(=O)C2=C(NC(=C2C)C(=O)OCC)C

InChI

InChI=1S/C22H31N3O3/c1-6-25(7-2)14-18-12-10-9-11-17(18)13-23-21(26)19-15(4)20(24-16(19)5)22(27)28-8-3/h9-12,24H,6-8,13-14H2,1-5H3,(H,23,26)