4-[3,5-dimethyl-4-[(4-nitrophenyl)methoxy]phenyl]-N-octadecyl-4-oxidanylidene-butanamide

Systemtic Name: 4-[3,5-dimethyl-4-[(4-nitrophenyl)methoxy]phenyl]-N-octadecyl-4-oxidanylidene-butanamide Openeye Name: 4-[3,5-dimethyl-4-[(4-nitrophenyl)methoxy]phenyl]-N-octadecyl-4-oxo-butanamide CAS Name: 4-[3,5-dimethyl-4-[(4-nitrophenyl)methoxy]phenyl]-N-octadecyl-4-oxobutanamide IUPAC Name: 4-[3,5-dimethyl-4-[(4-nitrophenyl)methoxy]phenyl]-N-octadecyl-4-oxobutanamide Traditional Name: 4-[3,5-dimethyl-4-(4-nitrobenzyl)oxy-phenyl]-4-keto-N-stearyl-butyramide Formula: C37H56N2O5 MolecularWeight: 608.85094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)CCC(=O)C1=CC(=C(C(=C1)C)OCC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)CCC(=O)C1=CC(=C(C(=C1)C)OCC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C37H56N2O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26-38-36(41)25-24-35(40)33-27-30(2)37(31(3)28-33)44-29-32-20-22-34(23-21-32)39(42)43/h20-23,27-28H,4-19,24-26,29H2,1-3H3,(H,38,41)