2-methyl-6-(1-morpholin-4-ylethoxy)-1-oxidanylidene-4-phenyl-isoquinoline-3-carbonitrile

Systemtic Name: 2-methyl-6-(1-morpholin-4-ylethoxy)-1-oxidanylidene-4-phenyl-isoquinoline-3-carbonitrile Openeye Name: 2-methyl-6-(1-morpholinoethoxy)-1-oxo-4-phenyl-isoquinoline-3-carbonitrile CAS Name: 2-methyl-6-[1-(4-morpholinyl)ethoxy]-1-oxo-4-phenyl-3-isoquinolinecarbonitrile IUPAC Name: 2-methyl-6-(1-morpholin-4-ylethoxy)-1-oxo-4-phenylisoquinoline-3-carbonitrile Traditional Name: 1-keto-2-methyl-6-(1-morpholinoethoxy)-4-phenyl-isoquinoline-3-carbonitrile Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCOCC1)OC2=CC3=C(C=C2)C(=O)N(C(=C3C4=CC=CC=C4)C#N)C

Isomeric SMILES

CC(N1CCOCC1)OC2=CC3=C(C=C2)C(=O)N(C(=C3C4=CC=CC=C4)C#N)C

InChI

InChI=1S/C23H23N3O3/c1-16(26-10-12-28-13-11-26)29-18-8-9-19-20(14-18)22(17-6-4-3-5-7-17)21(15-24)25(2)23(19)27/h3-9,14,16H,10-13H2,1-2H3