phenanthridin-6-ylmethyl 3-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: phenanthridin-6-ylmethyl 3-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: phenanthridin-6-ylmethyl 3-(p-tolylsulfonylamino)propanoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]propanoic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl 3-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(tosylamino)propionic acid phenanthridin-6-ylmethyl ester Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42

InChI

InChI=1S/C24H22N2O4S/c1-17-10-12-18(13-11-17)31(28,29)25-15-14-24(27)30-16-23-21-8-3-2-6-19(21)20-7-4-5-9-22(20)26-23/h2-13,25H,14-16H2,1H3