methyl 3-[6-(4-ethylpiperazin-1-yl)-6-oxidanylidene-hexyl]-2,4-bis(oxidanylidene)-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 3-[6-(4-ethylpiperazin-1-yl)-6-oxidanylidene-hexyl]-2,4-bis(oxidanylidene)-1H-quinazoline-7-carboxylate Openeye Name: methyl 3-[6-(4-ethylpiperazin-1-yl)-6-oxo-hexyl]-2,4-dioxo-1H-quinazoline-7-carboxylate CAS Name: 3-[6-(4-ethyl-1-piperazinyl)-6-oxohexyl]-2,4-dioxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 3-[6-(4-ethylpiperazin-1-yl)-6-oxohexyl]-2,4-dioxo-1H-quinazoline-7-carboxylate Traditional Name: 3-[6-(4-ethylpiperazino)-6-keto-hexyl]-2,4-diketo-1H-quinazoline-7-carboxylic acid methyl ester Formula: C22H30N4O5 MolecularWeight: 430.4974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)CCCCCN2C(=O)C3=C(C=C(C=C3)C(=O)OC)NC2=O

Isomeric SMILES

CCN1CCN(CC1)C(=O)CCCCCN2C(=O)C3=C(C=C(C=C3)C(=O)OC)NC2=O

InChI

InChI=1S/C22H30N4O5/c1-3-24-11-13-25(14-12-24)19(27)7-5-4-6-10-26-20(28)17-9-8-16(21(29)31-2)15-18(17)23-22(26)30/h8-9,15H,3-7,10-14H2,1-2H3,(H,23,30)