propan-2-yl 4-[2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-amino]ethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-amino]ethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-amino]acetyl]amino]benzoate CAS Name: 4-[[2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-ethylamino]-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl-ethylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl-ethyl-amino]acetyl]amino]benzoic acid isopropyl ester Formula: C23H25ClN4O4 MolecularWeight: 456.922

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(=O)NC3=CC=C(C=C3)C(=O)OC(C)C

Isomeric SMILES

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)CC(=O)NC3=CC=C(C=C3)C(=O)OC(C)C

InChI

InChI=1S/C23H25ClN4O4/c1-4-28(12-20-26-19-11-16(24)7-10-18(19)22(30)27-20)13-21(29)25-17-8-5-15(6-9-17)23(31)32-14(2)3/h5-11,14H,4,12-13H2,1-3H3,(H,25,29)(H,26,27,30)