tert-butyl 4-[[4-[(5-chloranyl-1,3-benzodioxol-4-yl)amino]quinazolin-5-yl]oxymethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-[(5-chloranyl-1,3-benzodioxol-4-yl)amino]quinazolin-5-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[4-[(5-chloro-1,3-benzodioxol-4-yl)amino]quinazolin-5-yl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[4-[(5-chloro-1,3-benzodioxol-4-yl)amino]-5-quinazolinyl]oxymethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-[(5-chloro-1,3-benzodioxol-4-yl)amino]quinazolin-5-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[4-[(5-chloro-1,3-benzodioxol-4-yl)amino]quinazolin-5-yl]oxymethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H29ClN4O5 MolecularWeight: 512.98526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)COC2=CC=CC3=C2C(=NC=N3)NC4=C(C=CC5=C4OCO5)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)COC2=CC=CC3=C2C(=NC=N3)NC4=C(C=CC5=C4OCO5)Cl

InChI

InChI=1S/C26H29ClN4O5/c1-26(2,3)36-25(32)31-11-9-16(10-12-31)13-33-19-6-4-5-18-21(19)24(29-14-28-18)30-22-17(27)7-8-20-23(22)35-15-34-20/h4-8,14,16H,9-13,15H2,1-3H3,(H,28,29,30)