(5-nitrothiophen-2-yl)-[4-(3,4,5-trimethoxyphenyl)carbonylpiperazin-1-yl]methanone

Systemtic Name: (5-nitrothiophen-2-yl)-[4-(3,4,5-trimethoxyphenyl)carbonylpiperazin-1-yl]methanone Openeye Name: (5-nitro-2-thienyl)-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methanone CAS Name: (5-nitro-2-thiophenyl)-[4-[oxo-(3,4,5-trimethoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (5-nitrothiophen-2-yl)-[4-(3,4,5-trimethoxybenzoyl)piperazin-1-yl]methanone Traditional Name: (5-nitro-2-thienyl)-[4-(3,4,5-trimethoxybenzoyl)piperazino]methanone Formula: C19H21N3O7S MolecularWeight: 435.45094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O7S/c1-27-13-10-12(11-14(28-2)17(13)29-3)18(23)20-6-8-21(9-7-20)19(24)15-4-5-16(30-15)22(25)26/h4-5,10-11H,6-9H2,1-3H3