7-methyl-2-[4-(oxolan-2-ylcarbonyl)-1,4-diazepan-1-yl]quinoline-3-carbonitrile

Systemtic Name: 7-methyl-2-[4-(oxolan-2-ylcarbonyl)-1,4-diazepan-1-yl]quinoline-3-carbonitrile Openeye Name: 7-methyl-2-[4-(tetrahydrofuran-2-carbonyl)-1,4-diazepan-1-yl]quinoline-3-carbonitrile CAS Name: 7-methyl-2-[4-[oxo(2-oxolanyl)methyl]-1,4-diazepan-1-yl]-3-quinolinecarbonitrile IUPAC Name: 7-methyl-2-[4-(oxolane-2-carbonyl)-1,4-diazepan-1-yl]quinoline-3-carbonitrile Traditional Name: 7-methyl-2-[4-(tetrahydrofuran-2-carbonyl)-1,4-diazepan-1-yl]quinoline-3-carbonitrile Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=N2)N3CCCN(CC3)C(=O)C4CCCO4)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=N2)N3CCCN(CC3)C(=O)C4CCCO4)C#N

InChI

InChI=1S/C21H24N4O2/c1-15-5-6-16-13-17(14-22)20(23-18(16)12-15)24-7-3-8-25(10-9-24)21(26)19-4-2-11-27-19/h5-6,12-13,19H,2-4,7-11H2,1H3