N-(3,4-dimethoxyphenyl)-2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-[4-(6-nitro-3-pyridyl)piperazin-1-yl]propanamide CAS Name: N-(3,4-dimethoxyphenyl)-2-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]propanamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propanamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-[4-(6-nitro-3-pyridyl)piperazino]propionamide Formula: C20H25N5O5 MolecularWeight: 415.443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)N2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)N2CCN(CC2)C3=CN=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H25N5O5/c1-14(20(26)22-15-4-6-17(29-2)18(12-15)30-3)23-8-10-24(11-9-23)16-5-7-19(21-13-16)25(27)28/h4-7,12-14H,8-11H2,1-3H3,(H,22,26)