methyl 3-azanyl-5-methylsulfonyl-4-piperidin-1-yl-benzoate

Systemtic Name: methyl 3-azanyl-5-methylsulfonyl-4-piperidin-1-yl-benzoate Openeye Name: methyl 3-amino-5-methylsulfonyl-4-(1-piperidyl)benzoate CAS Name: 3-amino-5-methylsulfonyl-4-(1-piperidinyl)benzoic acid methyl ester IUPAC Name: methyl 3-amino-5-methylsulfonyl-4-piperidin-1-ylbenzoate Traditional Name: 3-amino-5-mesyl-4-piperidino-benzoic acid methyl ester Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C(=C1)S(=O)(=O)C)N2CCCCC2)N

Isomeric SMILES

COC(=O)C1=CC(=C(C(=C1)S(=O)(=O)C)N2CCCCC2)N

InChI

InChI=1S/C14H20N2O4S/c1-20-14(17)10-8-11(15)13(12(9-10)21(2,18)19)16-6-4-3-5-7-16/h8-9H,3-7,15H2,1-2H3