tert-butyl 2-[[1-[2-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]oxyethyl]piperidin-4-yl]-(2-hydroxyethyl)amino]ethanoate

Systemtic Name: tert-butyl 2-[[1-[2-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]-7-methoxy-quinazolin-6-yl]oxyethyl]piperidin-4-yl]-(2-hydroxyethyl)amino]ethanoate Openeye Name: tert-butyl 2-[[1-[2-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]oxyethyl]-4-piperidyl]-(2-hydroxyethyl)amino]acetate CAS Name: 2-[[1-[2-[[4-(3-chloro-4-fluoroanilino)-7-methoxy-6-quinazolinyl]oxy]ethyl]-4-piperidinyl]-(2-hydroxyethyl)amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[1-[2-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]oxyethyl]piperidin-4-yl]-(2-hydroxyethyl)amino]acetate Traditional Name: 2-[[1-[2-[4-(3-chloro-4-fluoro-anilino)-7-methoxy-quinazolin-6-yl]oxyethyl]-4-piperidyl]-(2-hydroxyethyl)amino]acetic acid tert-butyl ester Formula: C30H39ClFN5O5 MolecularWeight: 604.112563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN(CCO)C1CCN(CC1)CCOC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OC

Isomeric SMILES

CC(C)(C)OC(=O)CN(CCO)C1CCN(CC1)CCOC2=C(C=C3C(=C2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl)OC

InChI

InChI=1S/C30H39ClFN5O5/c1-30(2,3)42-28(39)18-37(11-13-38)21-7-9-36(10-8-21)12-14-41-27-16-22-25(17-26(27)40-4)33-19-34-29(22)35-20-5-6-24(32)23(31)15-20/h5-6,15-17,19,21,38H,7-14,18H2,1-4H3,(H,33,34,35)