(2R)-2-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-4,4-dimethyl-pentanoic acid

Systemtic Name: (2R)-2-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-4,4-dimethyl-pentanoic acid Openeye Name: (2R)-2-[(4-methoxyphenyl)sulfonyl-(3-pyridylmethyl)amino]-4,4-dimethyl-pentanoic acid CAS Name: (2R)-2-[(4-methoxyphenyl)sulfonyl-(3-pyridinylmethyl)amino]-4,4-dimethylpentanoic acid IUPAC Name: (2R)-2-[(4-methoxyphenyl)sulfonyl-(pyridin-3-ylmethyl)amino]-4,4-dimethylpentanoic acid Traditional Name: (2R)-2-[(4-methoxyphenyl)sulfonyl-(3-pyridylmethyl)amino]-4,4-dimethyl-valeric acid Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C(=O)O)N(CC1=CN=CC=C1)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)C[C@H](C(=O)O)N(CC1=CN=CC=C1)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H26N2O5S/c1-20(2,3)12-18(19(23)24)22(14-15-6-5-11-21-13-15)28(25,26)17-9-7-16(27-4)8-10-17/h5-11,13,18H,12,14H2,1-4H3,(H,23,24)/t18-/m1/s1