methyl 2-[7-(4-azanyl-3-morpholin-2-yl-4-oxidanylidene-butoxy)-2-(ethoxycarbonylamino)-4H-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[7-(4-azanyl-3-morpholin-2-yl-4-oxidanylidene-butoxy)-2-(ethoxycarbonylamino)-4H-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[7-(4-amino-3-morpholin-2-yl-4-oxo-butoxy)-2-(ethoxycarbonylamino)-4H-quinazolin-3-yl]acetate CAS Name: 2-[7-[4-amino-3-(2-morpholinyl)-4-oxobutoxy]-2-(ethoxycarbonylamino)-4H-quinazolin-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[7-(4-amino-3-morpholin-2-yl-4-oxobutoxy)-2-(ethoxycarbonylamino)-4H-quinazolin-3-yl]acetate Traditional Name: 2-[7-(4-amino-4-keto-3-morpholin-2-yl-butoxy)-2-(carbethoxyamino)-4H-quinazolin-3-yl]acetic acid methyl ester Formula: C22H31N5O7 MolecularWeight: 477.51084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC2=C(CN1CC(=O)OC)C=CC(=C2)OCCC(C3CNCCO3)C(=O)N

Isomeric SMILES

CCOC(=O)NC1=NC2=C(CN1CC(=O)OC)C=CC(=C2)OCCC(C3CNCCO3)C(=O)N

InChI

InChI=1S/C22H31N5O7/c1-3-32-22(30)26-21-25-17-10-15(5-4-14(17)12-27(21)13-19(28)31-2)33-8-6-16(20(23)29)18-11-24-7-9-34-18/h4-5,10,16,18,24H,3,6-9,11-13H2,1-2H3,(H2,23,29)(H,25,26,30)