[2-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-(diphenylmethyl)azanium

Systemtic Name: [2-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-(diphenylmethyl)azanium Openeye Name: benzhydryl-[2-(4-chloro-3-morpholinosulfonyl-anilino)-2-oxo-ethyl]ammonium CAS Name: [2-[4-chloro-3-(4-morpholinylsulfonyl)anilino]-2-oxoethyl]-(diphenylmethyl)ammonium IUPAC Name: benzhydryl-[2-(4-chloro-3-morpholin-4-ylsulfonylanilino)-2-oxoethyl]azanium Traditional Name: benzhydryl-[2-(4-chloro-3-morpholinosulfonyl-anilino)-2-keto-ethyl]ammonium Formula: C25H27ClN3O4S+ MolecularWeight: 501.01758

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C[NH2+]C(C3=CC=CC=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C[NH2+]C(C3=CC=CC=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C25H26ClN3O4S/c26-22-12-11-21(17-23(22)34(31,32)29-13-15-33-16-14-29)28-24(30)18-27-25(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-12,17,25,27H,13-16,18H2,(H,28,30)/p+1