[3-ethynyl-5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]carbamic acid

Systemtic Name: [3-ethynyl-5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]carbamic acid Openeye Name: [3-ethynyl-5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]carbamic acid CAS Name: [3-ethynyl-5-(4-methyl-1-piperazinyl)-2-nitrophenyl]carbamic acid IUPAC Name: [3-ethynyl-5-(4-methylpiperazin-1-yl)-2-nitrophenyl]carbamic acid Traditional Name: [3-ethynyl-5-(4-methylpiperazino)-2-nitro-phenyl]carbamic acid Formula: C14H16N4O4 MolecularWeight: 304.30124

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=C(C(=C2)C#C)[N+](=O)[O-])NC(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=CC(=C(C(=C2)C#C)[N+](=O)[O-])NC(=O)O

InChI

InChI=1S/C14H16N4O4/c1-3-10-8-11(17-6-4-16(2)5-7-17)9-12(15-14(19)20)13(10)18(21)22/h1,8-9,15H,4-7H2,2H3,(H,19,20)