2-[2-(4-methoxyphenoxy)ethylamino]-5-piperidin-1-ylsulfonyl-benzoic acid

Systemtic Name: 2-[2-(4-methoxyphenoxy)ethylamino]-5-piperidin-1-ylsulfonyl-benzoic acid Openeye Name: 2-[2-(4-methoxyphenoxy)ethylamino]-5-(1-piperidylsulfonyl)benzoic acid CAS Name: 2-[2-(4-methoxyphenoxy)ethylamino]-5-(1-piperidinylsulfonyl)benzoic acid IUPAC Name: 2-[2-(4-methoxyphenoxy)ethylamino]-5-piperidin-1-ylsulfonylbenzoic acid Traditional Name: 2-[2-(4-methoxyphenoxy)ethylamino]-5-piperidinosulfonyl-benzoic acid Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCNC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)OCCNC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)C(=O)O

InChI

InChI=1S/C21H26N2O6S/c1-28-16-5-7-17(8-6-16)29-14-11-22-20-10-9-18(15-19(20)21(24)25)30(26,27)23-12-3-2-4-13-23/h5-10,15,22H,2-4,11-14H2,1H3,(H,24,25)