ethanedioic acid; N-methyl-N-(phenylmethyl)-3-(3-propan-2-ylphenoxy)propan-1-amine

Systemtic Name: ethanedioic acid; N-methyl-N-(phenylmethyl)-3-(3-propan-2-ylphenoxy)propan-1-amine Openeye Name: N-benzyl-3-(3-isopropylphenoxy)-N-methyl-propan-1-amine; oxalic acid CAS Name: N-methyl-N-(phenylmethyl)-3-(3-propan-2-ylphenoxy)-1-propanamine; oxalic acid IUPAC Name: N-benzyl-N-methyl-3-(3-propan-2-ylphenoxy)propan-1-amine; oxalic acid Traditional Name: benzyl-[3-(3-isopropylphenoxy)propyl]-methyl-amine; oxalic acid Formula: C22H29NO5 MolecularWeight: 387.46936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OCCCN(C)CC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)C1=CC(=CC=C1)OCCCN(C)CC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H27NO.C2H2O4/c1-17(2)19-11-7-12-20(15-19)22-14-8-13-21(3)16-18-9-5-4-6-10-18;3-1(4)2(5)6/h4-7,9-12,15,17H,8,13-14,16H2,1-3H3;(H,3,4)(H,5,6)