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1-[1-benzothiophen-2-yl-(3-methylpyridin-2-yl)methyl]piperidine-2-carboxylic acid

1-[1-benzothiophen-2-yl-(3-methylpyridin-2-yl)methyl]piperidine-2-carboxylic acid

Systemtic Name:1-[1-benzothiophen-2-yl-(3-methylpyridin-2-yl)methyl]piperidine-2-carboxylic acid
Openeye Name:1-[benzothiophen-2-yl-(3-methyl-2-pyridyl)methyl]piperidine-2-carboxylic acid
CAS Name:1-[1-benzothiophen-2-yl-(3-methyl-2-pyridinyl)methyl]-2-piperidinecarboxylic acid
IUPAC Name:1-[1-benzothiophen-2-yl-(3-methylpyridin-2-yl)methyl]piperidine-2-carboxylic acid
Traditional Name:1-[benzothiophen-2-yl-(3-methyl-2-pyridyl)methyl]pipecolinic acid
Formula: C21H22N2O2S
MolecularWeight: 366.47658
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C(C2=CC3=CC=CC=C3S2)N4CCCCC4C(=O)O


Isomeric SMILES

CC1=C(N=CC=C1)C(C2=CC3=CC=CC=C3S2)N4CCCCC4C(=O)O


InChI

InChI=1S/C21H22N2O2S/c1-14-7-6-11-22-19(14)20(23-12-5-4-9-16(23)21(24)25)18-13-15-8-2-3-10-17(15)26-18/h2-3,6-8,10-11,13,16,20H,4-5,9,12H2,1H3,(H,24,25)


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