(4-ethylphenyl)-[2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl]azanium

Systemtic Name: (4-ethylphenyl)-[2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl]azanium Openeye Name: [2-[benzyl(isopropyl)amino]-2-oxo-ethyl]-(4-ethylphenyl)ammonium CAS Name: (4-ethylphenyl)-[2-oxo-2-[(phenylmethyl)-propan-2-ylamino]ethyl]ammonium IUPAC Name: [2-[benzyl(propan-2-yl)amino]-2-oxoethyl]-(4-ethylphenyl)azanium Traditional Name: [2-[benzyl(isopropyl)amino]-2-keto-ethyl]-(4-ethylphenyl)ammonium Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)[NH2+]CC(=O)N(CC2=CC=CC=C2)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)[NH2+]CC(=O)N(CC2=CC=CC=C2)C(C)C

InChI

InChI=1S/C20H26N2O/c1-4-17-10-12-19(13-11-17)21-14-20(23)22(16(2)3)15-18-8-6-5-7-9-18/h5-13,16,21H,4,14-15H2,1-3H3/p+1