3-[4-[4-(4-nitrophenyl)piperazin-1-yl]carbonylphenyl]chromen-2-one

Systemtic Name: 3-[4-[4-(4-nitrophenyl)piperazin-1-yl]carbonylphenyl]chromen-2-one Openeye Name: 3-[4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]chromen-2-one CAS Name: 3-[4-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]phenyl]-1-benzopyran-2-one IUPAC Name: 3-[4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]chromen-2-one Traditional Name: 3-[4-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]coumarin Formula: C26H21N3O5 MolecularWeight: 455.46204

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C26H21N3O5/c30-25(28-15-13-27(14-16-28)21-9-11-22(12-10-21)29(32)33)19-7-5-18(6-8-19)23-17-20-3-1-2-4-24(20)34-26(23)31/h1-12,17H,13-16H2