3-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5-(methoxymethyl)-2-[(E)-2-phenylethenyl]phenyl]propan-1-amine; ethanedioic acid

Systemtic Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5-(methoxymethyl)-2-[(E)-2-phenylethenyl]phenyl]propan-1-amine; ethanedioic acid Openeye Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5-(methoxymethyl)-2-[(E)-styryl]phenyl]propan-1-amine; oxalic acid CAS Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5-(methoxymethyl)-2-[(E)-2-phenylethenyl]phenyl]-1-propanamine; oxalic acid IUPAC Name: 3-[3-[2-(3,4-dimethoxyphenyl)ethyl]-5-(methoxymethyl)-2-[(E)-2-phenylethenyl]phenyl]propan-1-amine; oxalic acid Traditional Name: 3-[3-homoveratryl-5-(methoxymethyl)-2-[(E)-styryl]phenyl]propylamine; oxalic acid Formula: C31H37NO7 MolecularWeight: 535.62798

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC(=C(C(=C1)CCCN)C=CC2=CC=CC=C2)CCC3=CC(=C(C=C3)OC)OC.C(=O)(C(=O)O)O

Isomeric SMILES

COCC1=CC(=C(C(=C1)CCCN)/C=C/C2=CC=CC=C2)CCC3=CC(=C(C=C3)OC)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C29H35NO3.C2H2O4/c1-31-21-24-18-25(10-7-17-30)27(15-12-22-8-5-4-6-9-22)26(19-24)14-11-23-13-16-28(32-2)29(20-23)33-3;3-1(4)2(5)6/h4-6,8-9,12-13,15-16,18-20H,7,10-11,14,17,21,30H2,1-3H3;(H,3,4)(H,5,6)/b15-12+;