(1-butyl-1,2,3,4-tetrazol-5-yl)methyl 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl 4-piperidin-1-ylsulfonylbenzoate Openeye Name: (1-butyltetrazol-5-yl)methyl 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid (1-butyltetrazol-5-yl)methyl ester Formula: C18H25N5O4S MolecularWeight: 407.4872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCCCN1C(=NN=N1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H25N5O4S/c1-2-3-13-23-17(19-20-21-23)14-27-18(24)15-7-9-16(10-8-15)28(25,26)22-11-5-4-6-12-22/h7-10H,2-6,11-14H2,1H3