4-[4-(2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxidanylidene-butoxy]-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[4-(2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxidanylidene-butoxy]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[4-(2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxo-butoxy]-3-methoxy-benzonitrile CAS Name: 4-[4-(2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxobutoxy]-3-methoxybenzonitrile IUPAC Name: 4-[4-(2,3-dihydro-1,4-benzoxazin-4-yl)-4-oxobutoxy]-3-methoxybenzonitrile Traditional Name: 4-[4-(2,3-dihydro-1,4-benzoxazin-4-yl)-4-keto-butoxy]-3-methoxy-benzonitrile Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OCCCC(=O)N2CCOC3=CC=CC=C32

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OCCCC(=O)N2CCOC3=CC=CC=C32

InChI

InChI=1S/C20H20N2O4/c1-24-19-13-15(14-21)8-9-18(19)25-11-4-7-20(23)22-10-12-26-17-6-3-2-5-16(17)22/h2-3,5-6,8-9,13H,4,7,10-12H2,1H3