(3-methyl-2-nitro-phenyl)-[4-(2-phenoxyethyl)piperazin-1-yl]methanone

Systemtic Name: (3-methyl-2-nitro-phenyl)-[4-(2-phenoxyethyl)piperazin-1-yl]methanone Openeye Name: (3-methyl-2-nitro-phenyl)-[4-(2-phenoxyethyl)piperazin-1-yl]methanone CAS Name: (3-methyl-2-nitrophenyl)-[4-(2-phenoxyethyl)-1-piperazinyl]methanone IUPAC Name: (3-methyl-2-nitrophenyl)-[4-(2-phenoxyethyl)piperazin-1-yl]methanone Traditional Name: (3-methyl-2-nitro-phenyl)-[4-(2-phenoxyethyl)piperazino]methanone Formula: C20H23N3O4 MolecularWeight: 369.41432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)CCOC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)CCOC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O4/c1-16-6-5-9-18(19(16)23(25)26)20(24)22-12-10-21(11-13-22)14-15-27-17-7-3-2-4-8-17/h2-9H,10-15H2,1H3