4-[4-[2-(2-isoquinolin-5-yl-1H-indol-3-yl)ethylamino]butyl]phenol

Systemtic Name: 4-[4-[2-(2-isoquinolin-5-yl-1H-indol-3-yl)ethylamino]butyl]phenol Openeye Name: 4-[4-[2-[2-(5-isoquinolyl)-1H-indol-3-yl]ethylamino]butyl]phenol CAS Name: 4-[4-[2-[2-(5-isoquinolinyl)-1H-indol-3-yl]ethylamino]butyl]phenol IUPAC Name: 4-[4-[2-(2-isoquinolin-5-yl-1H-indol-3-yl)ethylamino]butyl]phenol Traditional Name: 4-[4-[2-[2-(5-isoquinolyl)-1H-indol-3-yl]ethylamino]butyl]phenol Formula: C29H29N3O MolecularWeight: 435.56006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2)C3=CC=CC4=C3C=CN=C4)CCNCCCCC5=CC=C(C=C5)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2)C3=CC=CC4=C3C=CN=C4)CCNCCCCC5=CC=C(C=C5)O

InChI

InChI=1S/C29H29N3O/c33-23-13-11-21(12-14-23)6-3-4-17-30-18-16-27-25-8-1-2-10-28(25)32-29(27)26-9-5-7-22-20-31-19-15-24(22)26/h1-2,5,7-15,19-20,30,32-33H,3-4,6,16-18H2