[2-[[2-(cyclopentylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [2-[[2-(cyclopentylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-[2-[(cyclopentylamino)-oxomethyl]anilino]-2-oxoethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]-methylazanium Traditional Name: benzyl-[2-[2-(cyclopentylcarbamoyl)anilino]-2-keto-ethyl]-methyl-ammonium Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC=CC=C2C(=O)NC3CCCC3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC=CC=C2C(=O)NC3CCCC3

InChI

InChI=1S/C22H27N3O2/c1-25(15-17-9-3-2-4-10-17)16-21(26)24-20-14-8-7-13-19(20)22(27)23-18-11-5-6-12-18/h2-4,7-10,13-14,18H,5-6,11-12,15-16H2,1H3,(H,23,27)(H,24,26)/p+1