[3-methoxy-4-[2-oxidanylidene-2-(propan-2-ylamino)ethoxy]phenyl]methylazanium

Systemtic Name: [3-methoxy-4-[2-oxidanylidene-2-(propan-2-ylamino)ethoxy]phenyl]methylazanium Openeye Name: [4-[2-(isopropylamino)-2-oxo-ethoxy]-3-methoxy-phenyl]methylammonium CAS Name: [3-methoxy-4-[2-oxo-2-(propan-2-ylamino)ethoxy]phenyl]methylammonium IUPAC Name: [3-methoxy-4-[2-oxo-2-(propan-2-ylamino)ethoxy]phenyl]methylazanium Traditional Name: [4-[2-(isopropylamino)-2-keto-ethoxy]-3-methoxy-benzyl]ammonium Formula: C13H21N2O3+ MolecularWeight: 253.31744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)COC1=C(C=C(C=C1)C[NH3+])OC

Isomeric SMILES

CC(C)NC(=O)COC1=C(C=C(C=C1)C[NH3+])OC

InChI

InChI=1S/C13H20N2O3/c1-9(2)15-13(16)8-18-11-5-4-10(7-14)6-12(11)17-3/h4-6,9H,7-8,14H2,1-3H3,(H,15,16)/p+1