ethanedioic acid; 3-(4-methoxy-2-prop-2-enyl-phenoxy)-N-(phenylmethyl)propan-1-amine

Systemtic Name: ethanedioic acid; 3-(4-methoxy-2-prop-2-enyl-phenoxy)-N-(phenylmethyl)propan-1-amine Openeye Name: 3-(2-allyl-4-methoxy-phenoxy)-N-benzyl-propan-1-amine; oxalic acid CAS Name: 3-(4-methoxy-2-prop-2-enylphenoxy)-N-(phenylmethyl)-1-propanamine; oxalic acid IUPAC Name: N-benzyl-3-(4-methoxy-2-prop-2-enylphenoxy)propan-1-amine; oxalic acid Traditional Name: 3-(2-allyl-4-methoxy-phenoxy)propyl-benzyl-amine; oxalic acid Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCCCNCC2=CC=CC=C2)CC=C.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC(=C(C=C1)OCCCNCC2=CC=CC=C2)CC=C.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H25NO2.C2H2O4/c1-3-8-18-15-19(22-2)11-12-20(18)23-14-7-13-21-16-17-9-5-4-6-10-17;3-1(4)2(5)6/h3-6,9-12,15,21H,1,7-8,13-14,16H2,2H3;(H,3,4)(H,5,6)