4-ethoxycarbonyl-4-(2-nitrophenyl)hept-6-enoic acid

Systemtic Name: 4-ethoxycarbonyl-4-(2-nitrophenyl)hept-6-enoic acid Openeye Name: 4-ethoxycarbonyl-4-(2-nitrophenyl)hept-6-enoic acid CAS Name: 4-ethoxycarbonyl-4-(2-nitrophenyl)-6-heptenoic acid IUPAC Name: 4-ethoxycarbonyl-4-(2-nitrophenyl)hept-6-enoic acid Traditional Name: 4-carbethoxy-4-(2-nitrophenyl)hept-6-enoic acid Formula: C16H19NO6 MolecularWeight: 321.32516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19NO6/c1-3-10-16(11-9-14(18)19,15(20)23-4-2)12-7-5-6-8-13(12)17(21)22/h3,5-8H,1,4,9-11H2,2H3,(H,18,19)