1-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-2-[4-methoxy-3-(1-methoxypropan-2-ylamino)phenyl]hexan-1-one

Systemtic Name: 1-(3-azanylidene-5,6-diethoxy-4-fluoranyl-1H-isoindol-2-yl)-2-[4-methoxy-3-(1-methoxypropan-2-ylamino)phenyl]hexan-1-one Openeye Name: 1-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-2-[4-methoxy-3-[(2-methoxy-1-methyl-ethyl)amino]phenyl]hexan-1-one CAS Name: 1-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-2-[4-methoxy-3-(1-methoxypropan-2-ylamino)phenyl]-1-hexanone IUPAC Name: 1-(5,6-diethoxy-4-fluoro-3-imino-1H-isoindol-2-yl)-2-[4-methoxy-3-(1-methoxypropan-2-ylamino)phenyl]hexan-1-one Traditional Name: 1-(5,6-diethoxy-7-fluoro-1-imino-isoindolin-2-yl)-2-[4-methoxy-3-[(2-methoxy-1-methyl-ethyl)amino]phenyl]hexan-1-one Formula: C29H40FN3O5 MolecularWeight: 529.643403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=C(C=C1)OC)NC(C)COC)C(=O)N2CC3=CC(=C(C(=C3C2=N)F)OCC)OCC

Isomeric SMILES

CCCCC(C1=CC(=C(C=C1)OC)NC(C)COC)C(=O)N2CC3=CC(=C(C(=C3C2=N)F)OCC)OCC

InChI

InChI=1S/C29H40FN3O5/c1-7-10-11-21(19-12-13-23(36-6)22(14-19)32-18(4)17-35-5)29(34)33-16-20-15-24(37-8-2)27(38-9-3)26(30)25(20)28(33)31/h12-15,18,21,31-32H,7-11,16-17H2,1-6H3