2-methyl-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]carbonyl-benzenecarbonitrile

Systemtic Name: 2-methyl-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]carbonyl-benzenecarbonitrile Openeye Name: 2-methyl-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidine-1-carbonyl]benzonitrile CAS Name: 2-methyl-4-[oxo-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]methyl]benzonitrile IUPAC Name: 2-methyl-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidine-1-carbonyl]benzonitrile Traditional Name: 4-[4-(2-keto-4H-3,1-benzoxazin-1-yl)piperidine-1-carbonyl]-2-methyl-benzonitrile Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)C#N

InChI

InChI=1S/C22H21N3O3/c1-15-12-16(6-7-17(15)13-23)21(26)24-10-8-19(9-11-24)25-20-5-3-2-4-18(20)14-28-22(25)27/h2-7,12,19H,8-11,14H2,1H3