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

Systemtic Name: 4-[3,5-dimethyl-4-[(4-nitrophenyl)methoxy]phenyl]-4-oxidanylidene-N-phenethyl-butanamide Openeye Name: 4-[3,5-dimethyl-4-[(4-nitrophenyl)methoxy]phenyl]-4-oxo-N-phenethyl-butanamide CAS Name: 4-[3,5-dimethyl-4-[(4-nitrophenyl)methoxy]phenyl]-4-oxo-N-phenethylbutanamide IUPAC Name: 4-[3,5-dimethyl-4-[(4-nitrophenyl)methoxy]phenyl]-4-oxo-N-phenethylbutanamide Traditional Name: 4-[3,5-dimethyl-4-(4-nitrobenzyl)oxy-phenyl]-4-keto-N-phenethyl-butyramide Formula: C27H28N2O5 MolecularWeight: 460.52162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC2=CC=C(C=C2)[N+](=O)[O-])C)C(=O)CCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=C1OCC2=CC=C(C=C2)[N+](=O)[O-])C)C(=O)CCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C27H28N2O5/c1-19-16-23(25(30)12-13-26(31)28-15-14-21-6-4-3-5-7-21)17-20(2)27(19)34-18-22-8-10-24(11-9-22)29(32)33/h3-11,16-17H,12-15,18H2,1-2H3,(H,28,31)