methyl 4-oxidanylidene-2-[[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-1-yl]methyl]-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 4-oxidanylidene-2-[[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-1-yl]methyl]-1H-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-[[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-1-yl]methyl]-1H-quinazoline-7-carboxylate CAS Name: 4-oxo-2-[[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazinyl]methyl]-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-2-[[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]methyl]-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[[4-(2-keto-2-piperidino-ethyl)piperazino]methyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C22H29N5O4 MolecularWeight: 427.49676

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CN3CCN(CC3)CC(=O)N4CCCCC4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CN3CCN(CC3)CC(=O)N4CCCCC4

InChI

InChI=1S/C22H29N5O4/c1-31-22(30)16-5-6-17-18(13-16)23-19(24-21(17)29)14-25-9-11-26(12-10-25)15-20(28)27-7-3-2-4-8-27/h5-6,13H,2-4,7-12,14-15H2,1H3,(H,23,24,29)