ethyl 4-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-1,3,5-trimethyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-1,3,5-trimethyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 4-[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]-1,3,5-trimethyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1,3,5-trimethylpyrrole-2-carboxylate Traditional Name: 4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1,3,5-trimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)N2CCN(CC2)C3=CC=CC=C3OC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)N2CCN(CC2)C3=CC=CC=C3OC)C

InChI

InChI=1S/C22H29N3O4/c1-6-29-22(27)20-15(2)19(16(3)23(20)4)21(26)25-13-11-24(12-14-25)17-9-7-8-10-18(17)28-5/h7-10H,6,11-14H2,1-5H3