N-methylcyclopropanamine; 1-methyl-3-(4-phenylbutoxy)benzene

Systemtic Name: N-methylcyclopropanamine; 1-methyl-3-(4-phenylbutoxy)benzene Openeye Name: N-methylcyclopropanamine; 1-methyl-3-(4-phenylbutoxy)benzene CAS Name: N-methylcyclopropanamine; 1-methyl-3-(4-phenylbutoxy)benzene IUPAC Name: N-methylcyclopropanamine; 1-methyl-3-(4-phenylbutoxy)benzene Traditional Name: cyclopropyl(methyl)amine; 1-methyl-3-(4-phenylbutoxy)benzene Formula: C21H29NO MolecularWeight: 311.46106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCCC2=CC=CC=C2.CNC1CC1

Isomeric SMILES

CC1=CC(=CC=C1)OCCCCC2=CC=CC=C2.CNC1CC1

InChI

InChI=1S/C17H20O.C4H9N/c1-15-8-7-12-17(14-15)18-13-6-5-11-16-9-3-2-4-10-16;1-5-4-2-3-4/h2-4,7-10,12,14H,5-6,11,13H2,1H3;4-5H,2-3H2,1H3