[2-[[3-(cyclopropylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-(phenylmethyl)-propan-2-yl-azanium

Systemtic Name: [2-[[3-(cyclopropylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-(phenylmethyl)-propan-2-yl-azanium Openeye Name: benzyl-[2-[3-(cyclopropylcarbamoyl)anilino]-2-oxo-ethyl]-isopropyl-ammonium CAS Name: [2-[3-[(cyclopropylamino)-oxomethyl]anilino]-2-oxoethyl]-(phenylmethyl)-propan-2-ylammonium IUPAC Name: benzyl-[2-[3-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]-propan-2-ylazanium Traditional Name: benzyl-[2-[3-(cyclopropylcarbamoyl)anilino]-2-keto-ethyl]-isopropyl-ammonium Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3

Isomeric SMILES

CC(C)[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3

InChI

InChI=1S/C22H27N3O2/c1-16(2)25(14-17-7-4-3-5-8-17)15-21(26)23-20-10-6-9-18(13-20)22(27)24-19-11-12-19/h3-10,13,16,19H,11-12,14-15H2,1-2H3,(H,23,26)(H,24,27)/p+1