2-[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]-5-nitro-benzenecarbonitrile Openeye Name: 2-[4-(3-methoxybenzoyl)piperazin-1-yl]-5-nitro-benzonitrile CAS Name: 2-[4-[(3-methoxyphenyl)-oxomethyl]-1-piperazinyl]-5-nitrobenzonitrile IUPAC Name: 2-[4-(3-methoxybenzoyl)piperazin-1-yl]-5-nitrobenzonitrile Traditional Name: 2-(4-m-anisoylpiperazino)-5-nitro-benzonitrile Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C19H18N4O4/c1-27-17-4-2-3-14(12-17)19(24)22-9-7-21(8-10-22)18-6-5-16(23(25)26)11-15(18)13-20/h2-6,11-12H,7-10H2,1H3