indol-1-yl 2-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: indol-1-yl 2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: indol-1-yl 2-(p-tolylsulfonylamino)propanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]propanoic acid 1-indolyl ester IUPAC Name: indol-1-yl 2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 2-(tosylamino)propionic acid indol-1-yl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)ON2C=CC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)ON2C=CC3=CC=CC=C32

InChI

InChI=1S/C18H18N2O4S/c1-13-7-9-16(10-8-13)25(22,23)19-14(2)18(21)24-20-12-11-15-5-3-4-6-17(15)20/h3-12,14,19H,1-2H3