2-[5-[2-[1-(1H-indol-3-yl)propan-2-ylamino]-1-oxidanyl-ethyl]-2-oxidanyl-phenyl]ethanenitrile

Systemtic Name: 2-[5-[2-[1-(1H-indol-3-yl)propan-2-ylamino]-1-oxidanyl-ethyl]-2-oxidanyl-phenyl]ethanenitrile Openeye Name: 2-[2-hydroxy-5-[1-hydroxy-2-[[2-(1H-indol-3-yl)-1-methyl-ethyl]amino]ethyl]phenyl]acetonitrile CAS Name: 2-[2-hydroxy-5-[1-hydroxy-2-[1-(1H-indol-3-yl)propan-2-ylamino]ethyl]phenyl]acetonitrile IUPAC Name: 2-[2-hydroxy-5-[1-hydroxy-2-[1-(1H-indol-3-yl)propan-2-ylamino]ethyl]phenyl]acetonitrile Traditional Name: 2-[2-hydroxy-5-[1-hydroxy-2-[[2-(1H-indol-3-yl)-1-methyl-ethyl]amino]ethyl]phenyl]acetonitrile Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)NCC(C3=CC(=C(C=C3)O)CC#N)O

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)NCC(C3=CC(=C(C=C3)O)CC#N)O

InChI

InChI=1S/C21H23N3O2/c1-14(10-17-12-24-19-5-3-2-4-18(17)19)23-13-21(26)15-6-7-20(25)16(11-15)8-9-22/h2-7,11-12,14,21,23-26H,8,10,13H2,1H3