ethyl 4-(methylaminomethyl)benzoate; [2-methylpropoxy(phenyl)methyl]benzene

Systemtic Name: ethyl 4-(methylaminomethyl)benzoate; [2-methylpropoxy(phenyl)methyl]benzene Openeye Name: ethyl 4-(methylaminomethyl)benzoate; [isobutoxy(phenyl)methyl]benzene CAS Name: 4-(methylaminomethyl)benzoic acid ethyl ester; [2-methylpropoxy(phenyl)methyl]benzene IUPAC Name: ethyl 4-(methylaminomethyl)benzoate; [2-methylpropoxy(phenyl)methyl]benzene Traditional Name: [isobutoxy(phenyl)methyl]benzene; 4-(methylaminomethyl)benzoic acid ethyl ester Formula: C28H35NO3 MolecularWeight: 433.5824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CNC.CC(C)COC(C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CNC.CC(C)COC(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C17H20O.C11H15NO2/c1-14(2)13-18-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16;1-3-14-11(13)10-6-4-9(5-7-10)8-12-2/h3-12,14,17H,13H2,1-2H3;4-7,12H,3,8H2,1-2H3