1-[3-[4-(2-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]quinazoline-2,4-dione

Systemtic Name: 1-[3-[4-(2-nitrophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]quinazoline-2,4-dione Openeye Name: 1-[3-[4-(2-nitrophenyl)piperazin-1-yl]-3-oxo-propyl]quinazoline-2,4-dione CAS Name: 1-[3-[4-(2-nitrophenyl)-1-piperazinyl]-3-oxopropyl]quinazoline-2,4-dione IUPAC Name: 1-[3-[4-(2-nitrophenyl)piperazin-1-yl]-3-oxopropyl]quinazoline-2,4-dione Traditional Name: 1-[3-keto-3-[4-(2-nitrophenyl)piperazino]propyl]quinazoline-2,4-quinone Formula: C21H21N5O5 MolecularWeight: 423.42194

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)CCN3C4=CC=CC=C4C(=O)NC3=O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)CCN3C4=CC=CC=C4C(=O)NC3=O

InChI

InChI=1S/C21H21N5O5/c27-19(9-10-25-16-6-2-1-5-15(16)20(28)22-21(25)29)24-13-11-23(12-14-24)17-7-3-4-8-18(17)26(30)31/h1-8H,9-14H2,(H,22,28,29)