7-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-3-phenyl-1H-quinazoline-2,4-dione

Systemtic Name: 7-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-3-phenyl-1H-quinazoline-2,4-dione Openeye Name: 7-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-3-phenyl-1H-quinazoline-2,4-dione CAS Name: 7-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-3-phenyl-1H-quinazoline-2,4-dione IUPAC Name: 7-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-3-phenyl-1H-quinazoline-2,4-dione Traditional Name: 3-phenyl-7-(4-piperonylpiperazine-1-carbonyl)-1H-quinazoline-2,4-quinone Formula: C27H24N4O5 MolecularWeight: 484.50326

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=C(C=C4)C(=O)N(C(=O)N5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=C(C=C4)C(=O)N(C(=O)N5)C6=CC=CC=C6

InChI

InChI=1S/C27H24N4O5/c32-25(30-12-10-29(11-13-30)16-18-6-9-23-24(14-18)36-17-35-23)19-7-8-21-22(15-19)28-27(34)31(26(21)33)20-4-2-1-3-5-20/h1-9,14-15H,10-13,16-17H2,(H,28,34)