2-methyl-5-[2-[4-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methyl]piperidin-1-yl]ethoxy]quinoline-7-carbonitrile

Systemtic Name: 2-methyl-5-[2-[4-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)methyl]piperidin-1-yl]ethoxy]quinoline-7-carbonitrile Openeye Name: 2-methyl-5-[2-[4-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-1-piperidyl]ethoxy]quinoline-7-carbonitrile CAS Name: 2-methyl-5-[2-[4-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]-1-piperidinyl]ethoxy]-7-quinolinecarbonitrile IUPAC Name: 2-methyl-5-[2-[4-[(3-oxo-4H-1,4-benzoxazin-6-yl)methyl]piperidin-1-yl]ethoxy]quinoline-7-carbonitrile Traditional Name: 5-[2-[4-[(3-keto-4H-1,4-benzoxazin-6-yl)methyl]piperidino]ethoxy]-2-methyl-quinoline-7-carbonitrile Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC(=C2)C#N)OCCN3CCC(CC3)CC4=CC5=C(C=C4)OCC(=O)N5

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC(=C2)C#N)OCCN3CCC(CC3)CC4=CC5=C(C=C4)OCC(=O)N5

InChI

InChI=1S/C27H28N4O3/c1-18-2-4-22-23(29-18)14-21(16-28)15-26(22)33-11-10-31-8-6-19(7-9-31)12-20-3-5-25-24(13-20)30-27(32)17-34-25/h2-5,13-15,19H,6-12,17H2,1H3,(H,30,32)