4-[7-methoxy-6-(2-oxidanylidenepropoxy)quinazolin-4-yl]-N-(4-phenoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[7-methoxy-6-(2-oxidanylidenepropoxy)quinazolin-4-yl]-N-(4-phenoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-(6-acetonyloxy-7-methoxy-quinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide CAS Name: 4-[7-methoxy-6-(2-oxopropoxy)-4-quinazolinyl]-N-(4-phenoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[7-methoxy-6-(2-oxopropoxy)quinazolin-4-yl]-N-(4-phenoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(6-acetonyloxy-7-methoxy-quinazolin-4-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Formula: C29H29N5O5 MolecularWeight: 527.57106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)OC

Isomeric SMILES

CC(=O)COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)OC

InChI

InChI=1S/C29H29N5O5/c1-20(35)18-38-27-16-24-25(17-26(27)37-2)30-19-31-28(24)33-12-14-34(15-13-33)29(36)32-21-8-10-23(11-9-21)39-22-6-4-3-5-7-22/h3-11,16-17,19H,12-15,18H2,1-2H3,(H,32,36)