[2-[(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(1R)-1-naphthalen-1-ylethyl]azanium

Systemtic Name: [2-[(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-[(1R)-1-naphthalen-1-ylethyl]azanium Openeye Name: [2-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-anilino)-2-oxo-ethyl]-[(1R)-1-(1-naphthyl)ethyl]ammonium CAS Name: [2-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)anilino]-2-oxoethyl]-[(1R)-1-(1-naphthalenyl)ethyl]ammonium IUPAC Name: [2-(4-ethoxy-3-pyrrolidin-1-ylsulfonylanilino)-2-oxoethyl]-[(1R)-1-naphthalen-1-ylethyl]azanium Traditional Name: [2-(4-ethoxy-3-pyrrolidinosulfonyl-anilino)-2-keto-ethyl]-[(1R)-1-(1-naphthyl)ethyl]ammonium Formula: C26H32N3O4S+ MolecularWeight: 482.61498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C[NH2+]C(C)C2=CC=CC3=CC=CC=C32)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C[NH2+][C@H](C)C2=CC=CC3=CC=CC=C32)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C26H31N3O4S/c1-3-33-24-14-13-21(17-25(24)34(31,32)29-15-6-7-16-29)28-26(30)18-27-19(2)22-12-8-10-20-9-4-5-11-23(20)22/h4-5,8-14,17,19,27H,3,6-7,15-16,18H2,1-2H3,(H,28,30)/p+1/t19-/m1/s1