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

Systemtic Name: (3-nitro-4-pyrrolidin-1-yl-phenyl)-[4-(2-phenoxyethyl)piperazin-1-yl]methanone Openeye Name: (3-nitro-4-pyrrolidin-1-yl-phenyl)-[4-(2-phenoxyethyl)piperazin-1-yl]methanone CAS Name: [3-nitro-4-(1-pyrrolidinyl)phenyl]-[4-(2-phenoxyethyl)-1-piperazinyl]methanone IUPAC Name: (3-nitro-4-pyrrolidin-1-ylphenyl)-[4-(2-phenoxyethyl)piperazin-1-yl]methanone Traditional Name: (3-nitro-4-pyrrolidino-phenyl)-[4-(2-phenoxyethyl)piperazino]methanone Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CCOC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CCOC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O4/c28-23(19-8-9-21(22(18-19)27(29)30)25-10-4-5-11-25)26-14-12-24(13-15-26)16-17-31-20-6-2-1-3-7-20/h1-3,6-9,18H,4-5,10-17H2