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

Systemtic Name: 3-[3-[4-(4-nitrophenyl)piperazin-1-yl]carbonylphenyl]chromen-2-one Openeye Name: 3-[3-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]chromen-2-one CAS Name: 3-[3-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]phenyl]-1-benzopyran-2-one IUPAC Name: 3-[3-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]chromen-2-one Traditional Name: 3-[3-[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=CC(=C3)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

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

InChI

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