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

Systemtic Name: methyl 2,4-bis(oxidanylidene)-3-[6-oxidanylidene-6-(4-phenylpiperazin-1-yl)hexyl]-1H-quinazoline-7-carboxylate Openeye Name: methyl 2,4-dioxo-3-[6-oxo-6-(4-phenylpiperazin-1-yl)hexyl]-1H-quinazoline-7-carboxylate CAS Name: 2,4-dioxo-3-[6-oxo-6-(4-phenyl-1-piperazinyl)hexyl]-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dioxo-3-[6-oxo-6-(4-phenylpiperazin-1-yl)hexyl]-1H-quinazoline-7-carboxylate Traditional Name: 2,4-diketo-3-[6-keto-6-(4-phenylpiperazino)hexyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C26H30N4O5 MolecularWeight: 478.5402

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=O)N2)CCCCCC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=O)N2)CCCCCC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H30N4O5/c1-35-25(33)19-11-12-21-22(18-19)27-26(34)30(24(21)32)13-7-3-6-10-23(31)29-16-14-28(15-17-29)20-8-4-2-5-9-20/h2,4-5,8-9,11-12,18H,3,6-7,10,13-17H2,1H3,(H,27,34)