methyl 1-[2-[6,8-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[6,8-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(6,8-dichloro-4-oxo-quinazolin-3-yl)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(6,8-dichloro-4-oxo-3-quinazolinyl)-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(6,8-dichloro-4-oxoquinazolin-3-yl)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(6,8-dichloro-4-keto-quinazolin-3-yl)acetyl]isonipecotic acid methyl ester Formula: C17H17Cl2N3O4 MolecularWeight: 398.24058

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CN2C=NC3=C(C=C(C=C3C2=O)Cl)Cl

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CN2C=NC3=C(C=C(C=C3C2=O)Cl)Cl

InChI

InChI=1S/C17H17Cl2N3O4/c1-26-17(25)10-2-4-21(5-3-10)14(23)8-22-9-20-15-12(16(22)24)6-11(18)7-13(15)19/h6-7,9-10H,2-5,8H2,1H3