N-[4-nitro-3-(2-phenylbutanoylamino)phenyl]-2-phenyl-butanamide

Systemtic Name: N-[4-nitro-3-(2-phenylbutanoylamino)phenyl]-2-phenyl-butanamide Openeye Name: N-[4-nitro-3-(2-phenylbutanoylamino)phenyl]-2-phenyl-butanamide CAS Name: N-[4-nitro-3-[(1-oxo-2-phenylbutyl)amino]phenyl]-2-phenylbutanamide IUPAC Name: N-[4-nitro-3-(2-phenylbutanoylamino)phenyl]-2-phenylbutanamide Traditional Name: N-[4-nitro-3-(2-phenylbutanoylamino)phenyl]-2-phenyl-butyramide Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])NC(=O)C(CC)C3=CC=CC=C3

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])NC(=O)C(CC)C3=CC=CC=C3

InChI

InChI=1S/C26H27N3O4/c1-3-21(18-11-7-5-8-12-18)25(30)27-20-15-16-24(29(32)33)23(17-20)28-26(31)22(4-2)19-13-9-6-10-14-19/h5-17,21-22H,3-4H2,1-2H3,(H,27,30)(H,28,31)