ethyl 2-[[(2R)-2-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]propanoyl]amino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(2R)-2-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]propanoyl]amino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[(2R)-2-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]propanoyl]amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(2R)-2-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methylamino]-1-oxopropyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(2R)-2-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]propanoyl]amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[(2R)-2-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]propanoyl]amino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H32N3O3S+ MolecularWeight: 430.58348

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(C)C(=O)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CC[NH+]1CCC[C@@H]1CN[C@H](C)C(=O)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C23H31N3O3S/c1-4-26-13-9-12-18(26)15-24-16(3)21(27)25-22-19(23(28)29-5-2)14-20(30-22)17-10-7-6-8-11-17/h6-8,10-11,14,16,18,24H,4-5,9,12-13,15H2,1-3H3,(H,25,27)/p+1/t16-,18-/m1/s1