N-phenyl-2-[4-(3-piperidin-1-ylpropoxy)phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-7-sulfonamide

Systemtic Name: N-phenyl-2-[4-(3-piperidin-1-ylpropoxy)phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-7-sulfonamide Openeye Name: N-phenyl-2-[4-[3-(1-piperidyl)propoxy]benzoyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide CAS Name: 2-[oxo-[4-[3-(1-piperidinyl)propoxy]phenyl]methyl]-N-phenyl-3,4-dihydro-1H-isoquinoline-7-sulfonamide IUPAC Name: N-phenyl-2-[4-(3-piperidin-1-ylpropoxy)benzoyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide Traditional Name: N-phenyl-2-[4-(3-piperidinopropoxy)benzoyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide Formula: C30H35N3O4S MolecularWeight: 533.6816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)N3CCC4=C(C3)C=C(C=C4)S(=O)(=O)NC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)N3CCC4=C(C3)C=C(C=C4)S(=O)(=O)NC5=CC=CC=C5

InChI

InChI=1S/C30H35N3O4S/c34-30(25-10-13-28(14-11-25)37-21-7-19-32-17-5-2-6-18-32)33-20-16-24-12-15-29(22-26(24)23-33)38(35,36)31-27-8-3-1-4-9-27/h1,3-4,8-15,22,31H,2,5-7,16-21,23H2