2-azanyl-2-[1-methyl-4-[(4-methylphenyl)methylsulfanyl]piperidin-4-yl]ethanoic acid

Systemtic Name: 2-azanyl-2-[1-methyl-4-[(4-methylphenyl)methylsulfanyl]piperidin-4-yl]ethanoic acid Openeye Name: 2-amino-2-[1-methyl-4-(p-tolylmethylsulfanyl)-4-piperidyl]acetic acid CAS Name: 2-amino-2-[1-methyl-4-[(4-methylphenyl)methylthio]-4-piperidinyl]acetic acid IUPAC Name: 2-amino-2-[1-methyl-4-[(4-methylphenyl)methylsulfanyl]piperidin-4-yl]acetic acid Traditional Name: 2-amino-2-[1-methyl-4-[(4-methylbenzyl)thio]-4-piperidyl]acetic acid Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2(CCN(CC2)C)C(C(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)CSC2(CCN(CC2)C)C(C(=O)O)N

InChI

InChI=1S/C16H24N2O2S/c1-12-3-5-13(6-4-12)11-21-16(14(17)15(19)20)7-9-18(2)10-8-16/h3-6,14H,7-11,17H2,1-2H3,(H,19,20)