N-(2-methoxyphenyl)-6-[2-(5-oxidanyl-1H-indol-3-yl)ethylamino]heptanamide hydrate hydrochloride

Systemtic Name: N-(2-methoxyphenyl)-6-[2-(5-oxidanyl-1H-indol-3-yl)ethylamino]heptanamide hydrate hydrochloride Openeye Name: 6-[2-(5-hydroxy-1H-indol-3-yl)ethylamino]-N-(2-methoxyphenyl)heptanamide hydrate hydrochloride CAS Name: 6-[2-(5-hydroxy-1H-indol-3-yl)ethylamino]-N-(2-methoxyphenyl)heptanamide hydrate hydrochloride IUPAC Name: 6-[2-(5-hydroxy-1H-indol-3-yl)ethylamino]-N-(2-methoxyphenyl)heptanamide hydrate hydrochloride Traditional Name: 6-[2-(5-hydroxy-1H-indol-3-yl)ethylamino]-N-(2-methoxyphenyl)enanthamide hydrate hydrochloride Formula: C24H34ClN3O4 MolecularWeight: 463.99746

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCC(=O)NC1=CC=CC=C1OC)NCCC2=CNC3=C2C=C(C=C3)O.O.Cl

Isomeric SMILES

CC(CCCCC(=O)NC1=CC=CC=C1OC)NCCC2=CNC3=C2C=C(C=C3)O.O.Cl

InChI

InChI=1S/C24H31N3O3.ClH.H2O/c1-17(25-14-13-18-16-26-21-12-11-19(28)15-20(18)21)7-3-6-10-24(29)27-22-8-4-5-9-23(22)30-2;;/h4-5,8-9,11-12,15-17,25-26,28H,3,6-7,10,13-14H2,1-2H3,(H,27,29);1H;1H2