N-(5-chloranyl-1,3-benzodioxol-4-yl)-5-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine

Systemtic Name: N-(5-chloranyl-1,3-benzodioxol-4-yl)-5-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine Openeye Name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-[(1-methyl-4-piperidyl)methoxy]quinazolin-4-amine CAS Name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-[(1-methyl-4-piperidinyl)methoxy]-4-quinazolinamine IUPAC Name: N-(5-chloro-1,3-benzodioxol-4-yl)-5-[(1-methylpiperidin-4-yl)methoxy]quinazolin-4-amine Traditional Name: (5-chloro-1,3-benzodioxol-4-yl)-[5-[(1-methyl-4-piperidyl)methoxy]quinazolin-4-yl]amine Formula: C22H23ClN4O3 MolecularWeight: 426.89602

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)COC2=CC=CC3=C2C(=NC=N3)NC4=C(C=CC5=C4OCO5)Cl

Isomeric SMILES

CN1CCC(CC1)COC2=CC=CC3=C2C(=NC=N3)NC4=C(C=CC5=C4OCO5)Cl

InChI

InChI=1S/C22H23ClN4O3/c1-27-9-7-14(8-10-27)11-28-17-4-2-3-16-19(17)22(25-12-24-16)26-20-15(23)5-6-18-21(20)30-13-29-18/h2-6,12,14H,7-11,13H2,1H3,(H,24,25,26)