ethyl 2-[4-[6-azanyl-4-[(3-bromophenyl)amino]quinazolin-7-yl]oxypiperidin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[6-azanyl-4-[(3-bromophenyl)amino]quinazolin-7-yl]oxypiperidin-1-yl]ethanoate Openeye Name: ethyl 2-[4-[6-amino-4-(3-bromoanilino)quinazolin-7-yl]oxy-1-piperidyl]acetate CAS Name: 2-[4-[[6-amino-4-(3-bromoanilino)-7-quinazolinyl]oxy]-1-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[6-amino-4-(3-bromoanilino)quinazolin-7-yl]oxypiperidin-1-yl]acetate Traditional Name: 2-[4-[6-amino-4-(3-bromoanilino)quinazolin-7-yl]oxypiperidino]acetic acid ethyl ester Formula: C23H26BrN5O3 MolecularWeight: 500.38824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCC(CC1)OC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=CC=C4)Br)N

Isomeric SMILES

CCOC(=O)CN1CCC(CC1)OC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=CC=C4)Br)N

InChI

InChI=1S/C23H26BrN5O3/c1-2-31-22(30)13-29-8-6-17(7-9-29)32-21-12-20-18(11-19(21)25)23(27-14-26-20)28-16-5-3-4-15(24)10-16/h3-5,10-12,14,17H,2,6-9,13,25H2,1H3,(H,26,27,28)