4-[(5-chloranyl-1,3-benzodioxol-4-yl)amino]-5-(1-methylpiperidin-4-yl)oxy-1H-quinazolin-7-one

Systemtic Name: 4-[(5-chloranyl-1,3-benzodioxol-4-yl)amino]-5-(1-methylpiperidin-4-yl)oxy-1H-quinazolin-7-one Openeye Name: 4-[(5-chloro-1,3-benzodioxol-4-yl)amino]-5-[(1-methyl-4-piperidyl)oxy]-1H-quinazolin-7-one CAS Name: 4-[(5-chloro-1,3-benzodioxol-4-yl)amino]-5-[(1-methyl-4-piperidinyl)oxy]-1H-quinazolin-7-one IUPAC Name: 4-[(5-chloro-1,3-benzodioxol-4-yl)amino]-5-(1-methylpiperidin-4-yl)oxy-1H-quinazolin-7-one Traditional Name: 4-[(5-chloro-1,3-benzodioxol-4-yl)amino]-5-[(1-methyl-4-piperidyl)oxy]-1H-quinazolin-7-one Formula: C21H21ClN4O4 MolecularWeight: 428.86884

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)OC2=CC(=O)C=C3C2=C(N=CN3)NC4=C(C=CC5=C4OCO5)Cl

Isomeric SMILES

CN1CCC(CC1)OC2=CC(=O)C=C3C2=C(N=CN3)NC4=C(C=CC5=C4OCO5)Cl

InChI

InChI=1S/C21H21ClN4O4/c1-26-6-4-13(5-7-26)30-17-9-12(27)8-15-18(17)21(24-10-23-15)25-19-14(22)2-3-16-20(19)29-11-28-16/h2-3,8-10,13,25H,4-7,11H2,1H3,(H,23,24)