2-(4-propylphenyl)sulfonyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-1H-isoquinolin-6-ol

Systemtic Name: 2-(4-propylphenyl)sulfonyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-1H-isoquinolin-6-ol Openeye Name: 2-(4-propylphenyl)sulfonyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-1H-isoquinolin-6-ol CAS Name: 2-(4-propylphenyl)sulfonyl-1-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-3,4-dihydro-1H-isoquinolin-6-ol IUPAC Name: 2-(4-propylphenyl)sulfonyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-1H-isoquinolin-6-ol Traditional Name: 2-(4-propylphenyl)sulfonyl-1-[4-(2-pyrrolidinoethoxy)phenyl]-3,4-dihydro-1H-isoquinolin-6-ol Formula: C30H36N2O4S MolecularWeight: 520.68284

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2C4=CC=C(C=C4)OCCN5CCCC5)C=CC(=C3)O

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2C4=CC=C(C=C4)OCCN5CCCC5)C=CC(=C3)O

InChI

InChI=1S/C30H36N2O4S/c1-2-5-23-6-13-28(14-7-23)37(34,35)32-19-16-25-22-26(33)10-15-29(25)30(32)24-8-11-27(12-9-24)36-21-20-31-17-3-4-18-31/h6-15,22,30,33H,2-5,16-21H2,1H3