bis(phenylmethyl) (2R)-2-azanylpentanedioate; 4-methylbenzenesulfonic acid

Systemtic Name: bis(phenylmethyl) (2R)-2-azanylpentanedioate; 4-methylbenzenesulfonic acid Openeye Name: dibenzyl (2R)-2-aminopentanedioate; 4-methylbenzenesulfonic acid CAS Name: (2R)-2-aminopentanedioic acid bis(phenylmethyl) ester; 4-methylbenzenesulfonic acid IUPAC Name: dibenzyl (2R)-2-aminopentanedioate; 4-methylbenzenesulfonic acid Traditional Name: (2R)-2-aminoglutaric acid dibenzyl ester; tosylic acid Formula: C26H29NO7S MolecularWeight: 499.57596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)COC(=O)CCC(C(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)COC(=O)CC[C@H](C(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C19H21NO4.C7H8O3S/c20-17(19(22)24-14-16-9-5-2-6-10-16)11-12-18(21)23-13-15-7-3-1-4-8-15;1-6-2-4-7(5-3-6)11(8,9)10/h1-10,17H,11-14,20H2;2-5H,1H3,(H,8,9,10)/t17-;/m1./s1