methyl 3-azanyl-4-(3-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: methyl 3-azanyl-4-(3-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: methyl 3-amino-4-[(3-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 3-amino-4-[(3-methyl-1-piperidinyl)sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 3-amino-4-(3-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 3-amino-4-(3-methylpiperidino)sulfonyl-benzoic acid methyl ester Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=C(C=C2)C(=O)OC)N

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=C(C=C(C=C2)C(=O)OC)N

InChI

InChI=1S/C14H20N2O4S/c1-10-4-3-7-16(9-10)21(18,19)13-6-5-11(8-12(13)15)14(17)20-2/h5-6,8,10H,3-4,7,9,15H2,1-2H3