tert-butyl 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl-(4-methoxyphenyl)sulfonyl-amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl-(4-methoxyphenyl)sulfonyl-amino]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl-(4-methoxyphenyl)sulfonyl-amino]piperidine-1-carboxylate CAS Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl-(4-methoxyphenyl)sulfonylamino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl-(4-methoxyphenyl)sulfonylamino]piperidine-1-carboxylate Traditional Name: 3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl-(4-methoxyphenyl)sulfonyl-amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H34N2O7S MolecularWeight: 518.62236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)N(CC2=CC3=C(C=C2)OCCO3)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)N(CC2=CC3=C(C=C2)OCCO3)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H34N2O7S/c1-26(2,3)35-25(29)27-13-5-6-20(18-27)28(36(30,31)22-10-8-21(32-4)9-11-22)17-19-7-12-23-24(16-19)34-15-14-33-23/h7-12,16,20H,5-6,13-15,17-18H2,1-4H3