methyl (2S,4R)-1-[(3-methylthiophen-2-yl)methyl]-4-[(2-phenylphenyl)carbonylamino]pyrrolidin-1-ium-2-carboxylate

Systemtic Name: methyl (2S,4R)-1-[(3-methylthiophen-2-yl)methyl]-4-[(2-phenylphenyl)carbonylamino]pyrrolidin-1-ium-2-carboxylate Openeye Name: methyl (2S,4R)-1-[(3-methyl-2-thienyl)methyl]-4-[(2-phenylbenzoyl)amino]pyrrolidin-1-ium-2-carboxylate CAS Name: (2S,4R)-1-[(3-methyl-2-thiophenyl)methyl]-4-[[oxo-(2-phenylphenyl)methyl]amino]-2-pyrrolidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl (2S,4R)-1-[(3-methylthiophen-2-yl)methyl]-4-[(2-phenylbenzoyl)amino]pyrrolidin-1-ium-2-carboxylate Traditional Name: (2S,4R)-1-[(3-methyl-2-thienyl)methyl]-4-[(2-phenylbenzoyl)amino]pyrrolidin-1-ium-2-carboxylic acid methyl ester Formula: C25H27N2O3S+ MolecularWeight: 435.55848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+]2CC(CC2C(=O)OC)NC(=O)C3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC=C1)C[NH+]2C[C@@H](C[C@H]2C(=O)OC)NC(=O)C3=CC=CC=C3C4=CC=CC=C4

InChI

InChI=1S/C25H26N2O3S/c1-17-12-13-31-23(17)16-27-15-19(14-22(27)25(29)30-2)26-24(28)21-11-7-6-10-20(21)18-8-4-3-5-9-18/h3-13,19,22H,14-16H2,1-2H3,(H,26,28)/p+1/t19-,22+/m1/s1