methyl 3-[4-(cyclohexylmethyl)-5,6-dimethoxy-2-oxidanylidene-quinazolin-1-yl]propanoate

Systemtic Name: methyl 3-[4-(cyclohexylmethyl)-5,6-dimethoxy-2-oxidanylidene-quinazolin-1-yl]propanoate Openeye Name: methyl 3-[4-(cyclohexylmethyl)-5,6-dimethoxy-2-oxo-quinazolin-1-yl]propanoate CAS Name: 3-[4-(cyclohexylmethyl)-5,6-dimethoxy-2-oxo-1-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-(cyclohexylmethyl)-5,6-dimethoxy-2-oxoquinazolin-1-yl]propanoate Traditional Name: 3-[4-(cyclohexylmethyl)-2-keto-5,6-dimethoxy-quinazolin-1-yl]propionic acid methyl ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)N(C(=O)N=C2CC3CCCCC3)CCC(=O)OC)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)N(C(=O)N=C2CC3CCCCC3)CCC(=O)OC)OC

InChI

InChI=1S/C21H28N2O5/c1-26-17-10-9-16-19(20(17)28-3)15(13-14-7-5-4-6-8-14)22-21(25)23(16)12-11-18(24)27-2/h9-10,14H,4-8,11-13H2,1-3H3