(3-methoxy-4-phenylmethoxy-phenyl)-[(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)amino]methanol

Systemtic Name: (3-methoxy-4-phenylmethoxy-phenyl)-[(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)amino]methanol Openeye Name: (4-benzyloxy-3-methoxy-phenyl)-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-anilino)methanol CAS Name: (3-methoxy-4-phenylmethoxyphenyl)-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)anilino]methanol IUPAC Name: (3-methoxy-4-phenylmethoxyphenyl)-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylanilino)methanol Traditional Name: (4-benzoxy-3-methoxy-phenyl)-(5-morpholinosulfonyl-2-pyrrolidino-anilino)methanol Formula: C29H35N3O6S MolecularWeight: 553.6697

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4)O)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)C(NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4)O)OCC5=CC=CC=C5

InChI

InChI=1S/C29H35N3O6S/c1-36-28-19-23(9-12-27(28)38-21-22-7-3-2-4-8-22)29(33)30-25-20-24(10-11-26(25)31-13-5-6-14-31)39(34,35)32-15-17-37-18-16-32/h2-4,7-12,19-20,29-30,33H,5-6,13-18,21H2,1H3