[2-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-diphenethyl-azanium

Systemtic Name: [2-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-diphenethyl-azanium Openeye Name: [2-[4-methoxy-3-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]-diphenethyl-ammonium CAS Name: [2-[4-methoxy-3-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]-diphenethylammonium IUPAC Name: [2-(4-methoxy-3-piperidin-1-ylsulfonylanilino)-2-oxoethyl]-diphenethylazanium Traditional Name: [2-keto-2-(4-methoxy-3-piperidinosulfonyl-anilino)ethyl]-diphenethyl-ammonium Formula: C30H38N3O4S+ MolecularWeight: 536.70542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C[NH+](CCC2=CC=CC=C2)CCC3=CC=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C[NH+](CCC2=CC=CC=C2)CCC3=CC=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C30H37N3O4S/c1-37-28-16-15-27(23-29(28)38(35,36)33-19-9-4-10-20-33)31-30(34)24-32(21-17-25-11-5-2-6-12-25)22-18-26-13-7-3-8-14-26/h2-3,5-8,11-16,23H,4,9-10,17-22,24H2,1H3,(H,31,34)/p+1