ethyl 3-(dodecylamino)-3-(4-nitrophenyl)propanoate

Systemtic Name: ethyl 3-(dodecylamino)-3-(4-nitrophenyl)propanoate Openeye Name: ethyl 3-(dodecylamino)-3-(4-nitrophenyl)propanoate CAS Name: 3-(dodecylamino)-3-(4-nitrophenyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(dodecylamino)-3-(4-nitrophenyl)propanoate Traditional Name: 3-(laurylamino)-3-(4-nitrophenyl)propionic acid ethyl ester Formula: C23H38N2O4 MolecularWeight: 406.55882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(CC(=O)OCC)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCNC(CC(=O)OCC)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C23H38N2O4/c1-3-5-6-7-8-9-10-11-12-13-18-24-22(19-23(26)29-4-2)20-14-16-21(17-15-20)25(27)28/h14-17,22,24H,3-13,18-19H2,1-2H3