ethyl 3-[(6-chloranylnaphthalen-2-yl)sulfonylamino]-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: ethyl 3-[(6-chloranylnaphthalen-2-yl)sulfonylamino]-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: ethyl 2-(benzyloxycarbonylamino)-3-[(6-chloro-2-naphthyl)sulfonylamino]propanoate CAS Name: 3-[(6-chloro-2-naphthalenyl)sulfonylamino]-2-(phenylmethoxycarbonylamino)propanoic acid ethyl ester IUPAC Name: ethyl 3-[(6-chloronaphthalen-2-yl)sulfonylamino]-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-[(6-chloro-2-naphthyl)sulfonylamino]propionic acid ethyl ester Formula: C23H23ClN2O6S MolecularWeight: 490.95652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CNS(=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)Cl)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(CNS(=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)Cl)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H23ClN2O6S/c1-2-31-22(27)21(26-23(28)32-15-16-6-4-3-5-7-16)14-25-33(29,30)20-11-9-17-12-19(24)10-8-18(17)13-20/h3-13,21,25H,2,14-15H2,1H3,(H,26,28)