N-(5-chloranyl-1,3-benzodioxol-4-yl)-5-(1-methylpiperidin-4-yl)oxy-quinazolin-4-amine

Systemtic Name: N-(5-chloranyl-1,3-benzodioxol-4-yl)-5-(1-methylpiperidin-4-yl)oxy-quinazolin-4-amine Openeye Name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-[(1-methyl-4-piperidyl)oxy]quinazolin-4-amine CAS Name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-[(1-methyl-4-piperidinyl)oxy]-4-quinazolinamine IUPAC Name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-(1-methylpiperidin-4-yl)oxyquinazolin-4-amine Traditional Name: (5-chloro-1,3-benzodioxol-4-yl)-[5-[(1-methyl-4-piperidyl)oxy]quinazolin-4-yl]amine Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)OC2=CC=CC3=C2C(=NC=N3)NC4=C(C=CC5=C4OCO5)Cl

Isomeric SMILES

CN1CCC(CC1)OC2=CC=CC3=C2C(=NC=N3)NC4=C(C=CC5=C4OCO5)Cl

InChI

InChI=1S/C21H21ClN4O3/c1-26-9-7-13(8-10-26)29-16-4-2-3-15-18(16)21(24-11-23-15)25-19-14(22)5-6-17-20(19)28-12-27-17/h2-6,11,13H,7-10,12H2,1H3,(H,23,24,25)