[4-[4-(3-azanyl-4-phenylmethoxy-phenyl)-2,5-dimethoxy-phenyl]phenyl] methanesulfonate

Systemtic Name: [4-[4-(3-azanyl-4-phenylmethoxy-phenyl)-2,5-dimethoxy-phenyl]phenyl] methanesulfonate Openeye Name: [4-[4-(3-amino-4-benzyloxy-phenyl)-2,5-dimethoxy-phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[4-(3-amino-4-phenylmethoxyphenyl)-2,5-dimethoxyphenyl]phenyl] ester IUPAC Name: [4-[4-(3-amino-4-phenylmethoxyphenyl)-2,5-dimethoxyphenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[4-(3-amino-4-benzoxy-phenyl)-2,5-dimethoxy-phenyl]phenyl] ester Formula: C28H27NO6S MolecularWeight: 505.58208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)OC)C3=CC(=C(C=C3)OCC4=CC=CC=C4)N

Isomeric SMILES

COC1=CC(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)OC)C3=CC(=C(C=C3)OCC4=CC=CC=C4)N

InChI

InChI=1S/C28H27NO6S/c1-32-27-17-24(21-11-14-26(25(29)15-21)34-18-19-7-5-4-6-8-19)28(33-2)16-23(27)20-9-12-22(13-10-20)35-36(3,30)31/h4-17H,18,29H2,1-3H3