1-(4-ethoxyphenyl)-4-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonyl-pyrrolidin-2-one

Systemtic Name: 1-(4-ethoxyphenyl)-4-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonyl-pyrrolidin-2-one Openeye Name: 1-(4-ethoxyphenyl)-4-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]pyrrolidin-2-one CAS Name: 1-(4-ethoxyphenyl)-4-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-oxomethyl]-2-pyrrolidinone IUPAC Name: 1-(4-ethoxyphenyl)-4-[4-(6-nitropyridin-3-yl)piperazine-1-carbonyl]pyrrolidin-2-one Traditional Name: 4-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]-1-p-phenetyl-2-pyrrolidone Formula: C22H25N5O5 MolecularWeight: 439.4644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O5/c1-2-32-19-6-3-17(4-7-19)26-15-16(13-21(26)28)22(29)25-11-9-24(10-12-25)18-5-8-20(23-14-18)27(30)31/h3-8,14,16H,2,9-13,15H2,1H3