N,N-dimethyl-2-phenyl-ethanamine; (E)-2-[(2-phenylmethoxyphenoxy)methyl]but-2-enedioic acid

Systemtic Name: N,N-dimethyl-2-phenyl-ethanamine; (E)-2-[(2-phenylmethoxyphenoxy)methyl]but-2-enedioic acid Openeye Name: (E)-2-[(2-benzyloxyphenoxy)methyl]but-2-enedioic acid; N,N-dimethyl-2-phenyl-ethanamine CAS Name: N,N-dimethyl-2-phenylethanamine; (E)-2-[(2-phenylmethoxyphenoxy)methyl]-2-butenedioic acid IUPAC Name: N,N-dimethyl-2-phenylethanamine; (E)-2-[(2-phenylmethoxyphenoxy)methyl]but-2-enedioic acid Traditional Name: (E)-2-[(2-benzoxyphenoxy)methyl]but-2-enedioic acid; dimethyl(phenethyl)amine Formula: C28H31NO6 MolecularWeight: 477.54884

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=CC=CC=C1.C1=CC=C(C=C1)COC2=CC=CC=C2OCC(=CC(=O)O)C(=O)O

Isomeric SMILES

CN(C)CCC1=CC=CC=C1.C1=CC=C(C=C1)COC2=CC=CC=C2OC/C(=C\C(=O)O)/C(=O)O

InChI

InChI=1S/C18H16O6.C10H15N/c19-17(20)10-14(18(21)22)12-24-16-9-5-4-8-15(16)23-11-13-6-2-1-3-7-13;1-11(2)9-8-10-6-4-3-5-7-10/h1-10H,11-12H2,(H,19,20)(H,21,22);3-7H,8-9H2,1-2H3/b14-10+;