[3-methoxy-4-(3-phenylpropoxy)phenyl]methyl-propan-2-yl-azanium

Systemtic Name: [3-methoxy-4-(3-phenylpropoxy)phenyl]methyl-propan-2-yl-azanium Openeye Name: isopropyl-[[3-methoxy-4-(3-phenylpropoxy)phenyl]methyl]ammonium CAS Name: [3-methoxy-4-(3-phenylpropoxy)phenyl]methyl-propan-2-ylammonium IUPAC Name: [3-methoxy-4-(3-phenylpropoxy)phenyl]methyl-propan-2-ylazanium Traditional Name: isopropyl-[3-methoxy-4-(3-phenylpropoxy)benzyl]ammonium Formula: C20H28NO2+ MolecularWeight: 314.44182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]CC1=CC(=C(C=C1)OCCCC2=CC=CC=C2)OC

Isomeric SMILES

CC(C)[NH2+]CC1=CC(=C(C=C1)OCCCC2=CC=CC=C2)OC

InChI

InChI=1S/C20H27NO2/c1-16(2)21-15-18-11-12-19(20(14-18)22-3)23-13-7-10-17-8-5-4-6-9-17/h4-6,8-9,11-12,14,16,21H,7,10,13,15H2,1-3H3/p+1