phenanthridin-6-ylmethyl 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate

Systemtic Name: phenanthridin-6-ylmethyl 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]ethanoate Openeye Name: phenanthridin-6-ylmethyl 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]acetate CAS Name: 2-[[4-(dimethylamino)-3-nitrophenyl]sulfonylamino]acetic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl 2-[[4-(dimethylamino)-3-nitrophenyl]sulfonylamino]acetate Traditional Name: 2-[[4-(dimethylamino)-3-nitro-phenyl]sulfonylamino]acetic acid phenanthridin-6-ylmethyl ester Formula: C24H22N4O6S MolecularWeight: 494.51968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC2=NC3=CC=CC=C3C4=CC=CC=C42)[N+](=O)[O-]

InChI

InChI=1S/C24H22N4O6S/c1-27(2)22-12-11-16(13-23(22)28(30)31)35(32,33)25-14-24(29)34-15-21-19-9-4-3-7-17(19)18-8-5-6-10-20(18)26-21/h3-13,25H,14-15H2,1-2H3