4-acetamido-N-(3-methylpent-1-yn-3-yl)-3-nitro-benzamide

Systemtic Name: 4-acetamido-N-(3-methylpent-1-yn-3-yl)-3-nitro-benzamide Openeye Name: 4-acetamido-N-(1-ethyl-1-methyl-prop-2-ynyl)-3-nitro-benzamide CAS Name: 4-acetamido-N-(3-methylpent-1-yn-3-yl)-3-nitrobenzamide IUPAC Name: 4-acetamido-N-(3-methylpent-1-yn-3-yl)-3-nitrobenzamide Traditional Name: 4-acetamido-N-(1-ethyl-1-methyl-prop-2-ynyl)-3-nitro-benzamide Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C#C)NC(=O)C1=CC(=C(C=C1)NC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C#C)NC(=O)C1=CC(=C(C=C1)NC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O4/c1-5-15(4,6-2)17-14(20)11-7-8-12(16-10(3)19)13(9-11)18(21)22/h1,7-9H,6H2,2-4H3,(H,16,19)(H,17,20)