methyl 2-(3-nitrophenyl)pent-4-ynoate

Systemtic Name: methyl 2-(3-nitrophenyl)pent-4-ynoate Openeye Name: methyl 2-(3-nitrophenyl)pent-4-ynoate CAS Name: 2-(3-nitrophenyl)-4-pentynoic acid methyl ester IUPAC Name: methyl 2-(3-nitrophenyl)pent-4-ynoate Traditional Name: 2-(3-nitrophenyl)pent-4-ynoic acid methyl ester Formula: C12H11NO4 MolecularWeight: 233.22004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO4/c1-3-5-11(12(14)17-2)9-6-4-7-10(8-9)13(15)16/h1,4,6-8,11H,5H2,2H3