methyl 6-azanyl-2-[2-(6-chloranyl-2-naphthalen-2-yl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]hexanoate hydrochloride

Systemtic Name: methyl 6-azanyl-2-[2-(6-chloranyl-2-naphthalen-2-yl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]hexanoate hydrochloride Openeye Name: methyl 6-amino-2-[[2-[6-chloro-2-(2-naphthyl)-4-oxo-quinazolin-3-yl]acetyl]amino]hexanoate hydrochloride CAS Name: 6-amino-2-[[2-[6-chloro-2-(2-naphthalenyl)-4-oxo-3-quinazolinyl]-1-oxoethyl]amino]hexanoic acid methyl ester hydrochloride IUPAC Name: methyl 6-amino-2-[[2-(6-chloro-2-naphthalen-2-yl-4-oxoquinazolin-3-yl)acetyl]amino]hexanoate hydrochloride Traditional Name: 6-amino-2-[[2-[6-chloro-4-keto-2-(2-naphthyl)quinazolin-3-yl]acetyl]amino]hexanoic acid methyl ester hydrochloride Formula: C27H28Cl2N4O4 MolecularWeight: 543.44162

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCCN)NC(=O)CN1C(=NC2=C(C1=O)C=C(C=C2)Cl)C3=CC4=CC=CC=C4C=C3.Cl

Isomeric SMILES

COC(=O)C(CCCCN)NC(=O)CN1C(=NC2=C(C1=O)C=C(C=C2)Cl)C3=CC4=CC=CC=C4C=C3.Cl

InChI

InChI=1S/C27H27ClN4O4.ClH/c1-36-27(35)23(8-4-5-13-29)30-24(33)16-32-25(19-10-9-17-6-2-3-7-18(17)14-19)31-22-12-11-20(28)15-21(22)26(32)34;/h2-3,6-7,9-12,14-15,23H,4-5,8,13,16,29H2,1H3,(H,30,33);1H