2-[[3-(nitrooxymethyl)phenyl]carbonylamino]ethyl (2S)-2-(6-methoxynaphthalen-2-yl)propanoate

Systemtic Name: 2-[[3-(nitrooxymethyl)phenyl]carbonylamino]ethyl (2S)-2-(6-methoxynaphthalen-2-yl)propanoate Openeye Name: 2-[[3-(nitrooxymethyl)benzoyl]amino]ethyl (2S)-2-(6-methoxy-2-naphthyl)propanoate CAS Name: (2S)-2-(6-methoxy-2-naphthalenyl)propanoic acid 2-[[[3-(nitrooxymethyl)phenyl]-oxomethyl]amino]ethyl ester IUPAC Name: 2-[[3-(nitrooxymethyl)benzoyl]amino]ethyl (2S)-2-(6-methoxynaphthalen-2-yl)propanoate Traditional Name: (2S)-2-(6-methoxy-2-naphthyl)propionic acid 2-[[3-(nitrooxymethyl)benzoyl]amino]ethyl ester Formula: C24H24N2O7 MolecularWeight: 452.45656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCCNC(=O)C3=CC(=CC=C3)CO[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCCNC(=O)C3=CC(=CC=C3)CO[N+](=O)[O-]

InChI

InChI=1S/C24H24N2O7/c1-16(18-6-7-20-14-22(31-2)9-8-19(20)13-18)24(28)32-11-10-25-23(27)21-5-3-4-17(12-21)15-33-26(29)30/h3-9,12-14,16H,10-11,15H2,1-2H3,(H,25,27)/t16-/m0/s1