dimethyl (2R,6S)-2-azanyl-6-[(4-methylphenyl)sulfonylamino]heptanedioate

Systemtic Name: dimethyl (2R,6S)-2-azanyl-6-[(4-methylphenyl)sulfonylamino]heptanedioate Openeye Name: dimethyl (2R,6S)-2-amino-6-(p-tolylsulfonylamino)heptanedioate CAS Name: (2R,6S)-2-amino-6-[(4-methylphenyl)sulfonylamino]heptanedioic acid dimethyl ester IUPAC Name: dimethyl (2R,6S)-2-amino-6-[(4-methylphenyl)sulfonylamino]heptanedioate Traditional Name: (2R,6S)-2-amino-6-(tosylamino)pimelic acid dimethyl ester Formula: C16H24N2O6S MolecularWeight: 372.43656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCC(C(=O)OC)N)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CCC[C@H](C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C16H24N2O6S/c1-11-7-9-12(10-8-11)25(21,22)18-14(16(20)24-3)6-4-5-13(17)15(19)23-2/h7-10,13-14,18H,4-6,17H2,1-3H3/t13-,14+/m1/s1