[5-[[[2,6-di(propan-2-yl)phenyl]carbamoyl-propan-2-yl-amino]methyl]-2-methoxy-phenyl] ethanesulfonate

Systemtic Name: [5-[[[2,6-di(propan-2-yl)phenyl]carbamoyl-propan-2-yl-amino]methyl]-2-methoxy-phenyl] ethanesulfonate Openeye Name: [5-[[(2,6-diisopropylphenyl)carbamoyl-isopropyl-amino]methyl]-2-methoxy-phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [5-[[[[2,6-di(propan-2-yl)anilino]-oxomethyl]-propan-2-ylamino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[[2,6-di(propan-2-yl)phenyl]carbamoyl-propan-2-ylamino]methyl]-2-methoxyphenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-[[(2,6-diisopropylphenyl)carbamoyl-isopropyl-amino]methyl]-2-methoxy-phenyl] ester Formula: C26H38N2O5S MolecularWeight: 490.65532

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=C(C=CC(=C1)CN(C(C)C)C(=O)NC2=C(C=CC=C2C(C)C)C(C)C)OC

Isomeric SMILES

CCS(=O)(=O)OC1=C(C=CC(=C1)CN(C(C)C)C(=O)NC2=C(C=CC=C2C(C)C)C(C)C)OC

InChI

InChI=1S/C26H38N2O5S/c1-9-34(30,31)33-24-15-20(13-14-23(24)32-8)16-28(19(6)7)26(29)27-25-21(17(2)3)11-10-12-22(25)18(4)5/h10-15,17-19H,9,16H2,1-8H3,(H,27,29)