[2-chloranyl-5-ethoxy-4-[2-oxidanylidene-2-(phenethylamino)ethoxy]phenyl]methyl-propan-2-yl-azanium

Systemtic Name: [2-chloranyl-5-ethoxy-4-[2-oxidanylidene-2-(phenethylamino)ethoxy]phenyl]methyl-propan-2-yl-azanium Openeye Name: [2-chloro-5-ethoxy-4-[2-oxo-2-(phenethylamino)ethoxy]phenyl]methyl-isopropyl-ammonium CAS Name: [2-chloro-5-ethoxy-4-[2-oxo-2-(phenethylamino)ethoxy]phenyl]methyl-propan-2-ylammonium IUPAC Name: [2-chloro-5-ethoxy-4-[2-oxo-2-(phenethylamino)ethoxy]phenyl]methyl-propan-2-ylazanium Traditional Name: [2-chloro-5-ethoxy-4-[2-keto-2-(phenethylamino)ethoxy]benzyl]-isopropyl-ammonium Formula: C22H30ClN2O3+ MolecularWeight: 405.9382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C[NH2+]C(C)C)Cl)OCC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C[NH2+]C(C)C)Cl)OCC(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C22H29ClN2O3/c1-4-27-20-12-18(14-25-16(2)3)19(23)13-21(20)28-15-22(26)24-11-10-17-8-6-5-7-9-17/h5-9,12-13,16,25H,4,10-11,14-15H2,1-3H3,(H,24,26)/p+1