3-(3-methyl-4-nitro-phenoxy)-1-piperazin-1-yl-propan-1-one

Systemtic Name: 3-(3-methyl-4-nitro-phenoxy)-1-piperazin-1-yl-propan-1-one Openeye Name: 3-(3-methyl-4-nitro-phenoxy)-1-piperazin-1-yl-propan-1-one CAS Name: 3-(3-methyl-4-nitrophenoxy)-1-(1-piperazinyl)-1-propanone IUPAC Name: 3-(3-methyl-4-nitrophenoxy)-1-piperazin-1-ylpropan-1-one Traditional Name: 3-(3-methyl-4-nitro-phenoxy)-1-piperazino-propan-1-one Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCC(=O)N2CCNCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCCC(=O)N2CCNCC2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O4/c1-11-10-12(2-3-13(11)17(19)20)21-9-4-14(18)16-7-5-15-6-8-16/h2-3,10,15H,4-9H2,1H3