3,4-dihydro-2H-chromen-3-yl-[4-(2-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: 3,4-dihydro-2H-chromen-3-yl-[4-(2-nitrophenyl)piperazin-1-yl]methanone Openeye Name: chroman-3-yl-[4-(2-nitrophenyl)piperazin-1-yl]methanone CAS Name: 3,4-dihydro-2H-1-benzopyran-3-yl-[4-(2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: 3,4-dihydro-2H-chromen-3-yl-[4-(2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: chroman-3-yl-[4-(2-nitrophenyl)piperazino]methanone Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)C3CC4=CC=CC=C4OC3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)C3CC4=CC=CC=C4OC3

InChI

InChI=1S/C20H21N3O4/c24-20(16-13-15-5-1-4-8-19(15)27-14-16)22-11-9-21(10-12-22)17-6-2-3-7-18(17)23(25)26/h1-8,16H,9-14H2