cyclopropyl-(2-oxidanylidene-2-phenylazanyl-ethyl)-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: cyclopropyl-(2-oxidanylidene-2-phenylazanyl-ethyl)-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: (2-anilino-2-oxo-ethyl)-cyclopropyl-[(4-isopropylphenyl)methyl]ammonium CAS Name: (2-anilino-2-oxoethyl)-cyclopropyl-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: (2-anilino-2-oxoethyl)-cyclopropyl-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: (2-anilino-2-keto-ethyl)-cyclopropyl-(4-isopropylbenzyl)ammonium Formula: C21H27N2O+ MolecularWeight: 323.45188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+](CC(=O)NC2=CC=CC=C2)C3CC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+](CC(=O)NC2=CC=CC=C2)C3CC3

InChI

InChI=1S/C21H26N2O/c1-16(2)18-10-8-17(9-11-18)14-23(20-12-13-20)15-21(24)22-19-6-4-3-5-7-19/h3-11,16,20H,12-15H2,1-2H3,(H,22,24)/p+1