7-methoxy-2-[2-(4-methylpiperazin-1-yl)pyridin-3-yl]-5-propan-2-yl-3,1-benzoxazin-4-one

Systemtic Name: 7-methoxy-2-[2-(4-methylpiperazin-1-yl)pyridin-3-yl]-5-propan-2-yl-3,1-benzoxazin-4-one Openeye Name: 5-isopropyl-7-methoxy-2-[2-(4-methylpiperazin-1-yl)-3-pyridyl]-3,1-benzoxazin-4-one CAS Name: 7-methoxy-2-[2-(4-methyl-1-piperazinyl)-3-pyridinyl]-5-propan-2-yl-3,1-benzoxazin-4-one IUPAC Name: 7-methoxy-2-[2-(4-methylpiperazin-1-yl)pyridin-3-yl]-5-propan-2-yl-3,1-benzoxazin-4-one Traditional Name: 5-isopropyl-7-methoxy-2-[2-(4-methylpiperazino)-3-pyridyl]-3,1-benzoxazin-4-one Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC2=C1C(=O)OC(=N2)C3=C(N=CC=C3)N4CCN(CC4)C)OC

Isomeric SMILES

CC(C)C1=CC(=CC2=C1C(=O)OC(=N2)C3=C(N=CC=C3)N4CCN(CC4)C)OC

InChI

InChI=1S/C22H26N4O3/c1-14(2)17-12-15(28-4)13-18-19(17)22(27)29-21(24-18)16-6-5-7-23-20(16)26-10-8-25(3)9-11-26/h5-7,12-14H,8-11H2,1-4H3