6-[2-(5-oxidanyl-1H-indol-3-yl)ethylamino]-N-(4-pentoxyphenyl)hexanamide hydrate hydrochloride

Systemtic Name: 6-[2-(5-oxidanyl-1H-indol-3-yl)ethylamino]-N-(4-pentoxyphenyl)hexanamide hydrate hydrochloride Openeye Name: 6-[2-(5-hydroxy-1H-indol-3-yl)ethylamino]-N-(4-pentoxyphenyl)hexanamide hydrate hydrochloride CAS Name: 6-[2-(5-hydroxy-1H-indol-3-yl)ethylamino]-N-(4-pentoxyphenyl)hexanamide hydrate hydrochloride IUPAC Name: 6-[2-(5-hydroxy-1H-indol-3-yl)ethylamino]-N-(4-pentoxyphenyl)hexanamide hydrate hydrochloride Traditional Name: N-(4-amoxyphenyl)-6-[2-(5-hydroxy-1H-indol-3-yl)ethylamino]hexanamide hydrate hydrochloride Formula: C27H40ClN3O4 MolecularWeight: 506.0772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=O)CCCCCNCCC2=CNC3=C2C=C(C=C3)O.O.Cl

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=O)CCCCCNCCC2=CNC3=C2C=C(C=C3)O.O.Cl

InChI

InChI=1S/C27H37N3O3.ClH.H2O/c1-2-3-7-18-33-24-12-9-22(10-13-24)30-27(32)8-5-4-6-16-28-17-15-21-20-29-26-14-11-23(31)19-25(21)26;;/h9-14,19-20,28-29,31H,2-8,15-18H2,1H3,(H,30,32);1H;1H2