phenanthridin-6-ylmethyl 4-chloranyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: phenanthridin-6-ylmethyl 4-chloranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: phenanthridin-6-ylmethyl 4-chloro-3-morpholinosulfonyl-benzoate CAS Name: 4-chloro-3-(4-morpholinylsulfonyl)benzoic acid 6-phenanthridinylmethyl ester IUPAC Name: phenanthridin-6-ylmethyl 4-chloro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-chloro-3-morpholinosulfonyl-benzoic acid phenanthridin-6-ylmethyl ester Formula: C25H21ClN2O5S MolecularWeight: 496.96264

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=NC4=CC=CC=C4C5=CC=CC=C53)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=NC4=CC=CC=C4C5=CC=CC=C53)Cl

InChI

InChI=1S/C25H21ClN2O5S/c26-21-10-9-17(15-24(21)34(30,31)28-11-13-32-14-12-28)25(29)33-16-23-20-7-2-1-5-18(20)19-6-3-4-8-22(19)27-23/h1-10,15H,11-14,16H2