(3S,4S,5S)-4-methoxycarbonyl-1,5-bis(4-methylphenyl)-2-oxidanylidene-pyrrolidine-3-carboxylic acid

Systemtic Name: (3S,4S,5S)-4-methoxycarbonyl-1,5-bis(4-methylphenyl)-2-oxidanylidene-pyrrolidine-3-carboxylic acid Openeye Name: (3S,4S,5S)-4-methoxycarbonyl-2-oxo-1,5-bis(p-tolyl)pyrrolidine-3-carboxylic acid CAS Name: (3S,4S,5S)-4-methoxycarbonyl-1,5-bis(4-methylphenyl)-2-oxo-3-pyrrolidinecarboxylic acid IUPAC Name: (3S,4S,5S)-4-methoxycarbonyl-1,5-bis(4-methylphenyl)-2-oxopyrrolidine-3-carboxylic acid Traditional Name: (3S,4S,5S)-4-carbomethoxy-2-keto-1,5-bis(p-tolyl)pyrrolidine-3-carboxylic acid Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(C(=O)N2C3=CC=C(C=C3)C)C(=O)O)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]2[C@H]([C@@H](C(=O)N2C3=CC=C(C=C3)C)C(=O)O)C(=O)OC

InChI

InChI=1S/C21H21NO5/c1-12-4-8-14(9-5-12)18-16(21(26)27-3)17(20(24)25)19(23)22(18)15-10-6-13(2)7-11-15/h4-11,16-18H,1-3H3,(H,24,25)/t16-,17-,18+/m0/s1