(2-nitrophenyl) dodecanoate

Systemtic Name: (2-nitrophenyl) dodecanoate Openeye Name: (2-nitrophenyl) dodecanoate CAS Name: dodecanoic acid (2-nitrophenyl) ester IUPAC Name: (2-nitrophenyl) dodecanoate Traditional Name: lauric acid (2-nitrophenyl) ester Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(=O)OC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C18H27NO4/c1-2-3-4-5-6-7-8-9-10-15-18(20)23-17-14-12-11-13-16(17)19(21)22/h11-14H,2-10,15H2,1H3