7-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-yl]-6-nitro-1H-quinazolin-4-one

Systemtic Name: 7-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-yl]-6-nitro-1H-quinazolin-4-one Openeye Name: 7-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]-6-nitro-1H-quinazolin-4-one CAS Name: 7-[4-[2-(4-chlorophenoxy)ethyl]-1-piperazinyl]-6-nitro-1H-quinazolin-4-one IUPAC Name: 7-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]-6-nitro-1H-quinazolin-4-one Traditional Name: 7-[4-[2-(4-chlorophenoxy)ethyl]piperazino]-6-nitro-1H-quinazolin-4-one Formula: C20H20ClN5O4 MolecularWeight: 429.8569

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=C(C=C2)Cl)C3=C(C=C4C(=C3)NC=NC4=O)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCOC2=CC=C(C=C2)Cl)C3=C(C=C4C(=C3)NC=NC4=O)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN5O4/c21-14-1-3-15(4-2-14)30-10-9-24-5-7-25(8-6-24)18-12-17-16(11-19(18)26(28)29)20(27)23-13-22-17/h1-4,11-13H,5-10H2,(H,22,23,27)