methyl 2-ethyl-5-[[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]-4-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-ethyl-5-[[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]-4-methyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-ethyl-5-[[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]-4-methyl-1H-pyrrole-3-carboxylate CAS Name: 2-ethyl-5-[[[(2R)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]amino]-oxomethyl]-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-5-[[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]carbamoyl]-4-methyl-1H-pyrrole-3-carboxylate Traditional Name: 2-ethyl-5-[[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]carbamoyl]-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C23H32N3O4+ MolecularWeight: 414.51788

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NCC(C2=CC=C(C=C2)OC)[NH+]3CCCC3)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NC[C@@H](C2=CC=C(C=C2)OC)[NH+]3CCCC3)C)C(=O)OC

InChI

InChI=1S/C23H31N3O4/c1-5-18-20(23(28)30-4)15(2)21(25-18)22(27)24-14-19(26-12-6-7-13-26)16-8-10-17(29-3)11-9-16/h8-11,19,25H,5-7,12-14H2,1-4H3,(H,24,27)/p+1/t19-/m0/s1