phenanthridin-6-ylmethyl 2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoate

Systemtic Name: phenanthridin-6-ylmethyl 2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: phenanthridin-6-ylmethyl 2-[methyl(p-tolylsulfonyl)amino]acetate CAS Name: 2-[methyl-(4-methylphenyl)sulfonylamino]acetic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl 2-[methyl-(4-methylphenyl)sulfonylamino]acetate Traditional Name: 2-[methyl(tosyl)amino]acetic 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)N(C)CC(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42

Isomeric SMILES

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

InChI

InChI=1S/C24H22N2O4S/c1-17-11-13-18(14-12-17)31(28,29)26(2)15-24(27)30-16-23-21-9-4-3-7-19(21)20-8-5-6-10-22(20)25-23/h3-14H,15-16H2,1-2H3