2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-piperidin-1-ylphenyl)propanamide

Systemtic Name: 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-piperidin-1-ylphenyl)propanamide Openeye Name: 2-(4-nitro-1,3-dioxo-isoindolin-2-yl)-N-[4-(1-piperidyl)phenyl]propanamide CAS Name: 2-(4-nitro-1,3-dioxo-2-isoindolyl)-N-[4-(1-piperidinyl)phenyl]propanamide IUPAC Name: 2-(4-nitro-1,3-dioxoisoindol-2-yl)-N-(4-piperidin-1-ylphenyl)propanamide Traditional Name: 2-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-(4-piperidinophenyl)propionamide Formula: C22H22N4O5 MolecularWeight: 422.43388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCCCC2)N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N2CCCCC2)N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O5/c1-14(25-21(28)17-6-5-7-18(26(30)31)19(17)22(25)29)20(27)23-15-8-10-16(11-9-15)24-12-3-2-4-13-24/h5-11,14H,2-4,12-13H2,1H3,(H,23,27)