4-[(4-methoxyphenyl)methoxycarbonylamino]butyl 4-methylbenzenesulfonate

Systemtic Name: 4-[(4-methoxyphenyl)methoxycarbonylamino]butyl 4-methylbenzenesulfonate Openeye Name: 4-[(4-methoxyphenyl)methoxycarbonylamino]butyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 4-[[(4-methoxyphenyl)methoxy-oxomethyl]amino]butyl ester IUPAC Name: 4-[(4-methoxyphenyl)methoxycarbonylamino]butyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 4-(p-anisyloxycarbonylamino)butyl ester Formula: C20H25NO6S MolecularWeight: 407.4806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCCNC(=O)OCC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCCNC(=O)OCC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H25NO6S/c1-16-5-11-19(12-6-16)28(23,24)27-14-4-3-13-21-20(22)26-15-17-7-9-18(25-2)10-8-17/h5-12H,3-4,13-15H2,1-2H3,(H,21,22)