ethyl 3-[(4-nitrophenyl)sulfonyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[(4-nitrophenyl)sulfonyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-(4-nitrophenyl)sulfonyl-amino]propanoate CAS Name: 3-[(4-nitrophenyl)sulfonyl-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-(4-nitrophenyl)sulfonylamino]propanoate Traditional Name: 3-[benzyl(nosyl)amino]propionic acid ethyl ester Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O6S/c1-2-26-18(21)12-13-19(14-15-6-4-3-5-7-15)27(24,25)17-10-8-16(9-11-17)20(22)23/h3-11H,2,12-14H2,1H3