1-(4-nitrophenyl)-2-(tetradecan-2-ylamino)propane-1,3-diol

Systemtic Name: 1-(4-nitrophenyl)-2-(tetradecan-2-ylamino)propane-1,3-diol Openeye Name: 2-(1-methyltridecylamino)-1-(4-nitrophenyl)propane-1,3-diol CAS Name: 1-(4-nitrophenyl)-2-(tetradecan-2-ylamino)propane-1,3-diol IUPAC Name: 1-(4-nitrophenyl)-2-(tetradecan-2-ylamino)propane-1,3-diol Traditional Name: 2-(1-methyltridecylamino)-1-(4-nitrophenyl)propane-1,3-diol Formula: C23H40N2O4 MolecularWeight: 408.5747

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C)NC(CO)C(C1=CC=C(C=C1)[N+](=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCC(C)NC(CO)C(C1=CC=C(C=C1)[N+](=O)[O-])O

InChI

InChI=1S/C23H40N2O4/c1-3-4-5-6-7-8-9-10-11-12-13-19(2)24-22(18-26)23(27)20-14-16-21(17-15-20)25(28)29/h14-17,19,22-24,26-27H,3-13,18H2,1-2H3