6-[2-(aminomethyl)-6-[(E)-4-(3-methoxy-4-phenylmethoxy-phenyl)but-3-enyl]phenyl]hexanal

Systemtic Name: 6-[2-(aminomethyl)-6-[(E)-4-(3-methoxy-4-phenylmethoxy-phenyl)but-3-enyl]phenyl]hexanal Openeye Name: 6-[2-(aminomethyl)-6-[(E)-4-(4-benzyloxy-3-methoxy-phenyl)but-3-enyl]phenyl]hexanal CAS Name: 6-[2-(aminomethyl)-6-[(E)-4-(3-methoxy-4-phenylmethoxyphenyl)but-3-enyl]phenyl]hexanal IUPAC Name: 6-[2-(aminomethyl)-6-[(E)-4-(3-methoxy-4-phenylmethoxyphenyl)but-3-enyl]phenyl]hexanal Traditional Name: 6-[2-(aminomethyl)-6-[(E)-4-(4-benzoxy-3-methoxy-phenyl)but-3-enyl]phenyl]hexanal Formula: C31H37NO3 MolecularWeight: 471.63038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CCCC2=C(C(=CC=C2)CN)CCCCCC=O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/CCC2=C(C(=CC=C2)CN)CCCCCC=O)OCC3=CC=CC=C3

InChI

InChI=1S/C31H37NO3/c1-34-31-22-25(19-20-30(31)35-24-26-13-5-4-6-14-26)12-8-9-15-27-16-11-17-28(23-32)29(27)18-7-2-3-10-21-33/h4-6,8,11-14,16-17,19-22H,2-3,7,9-10,15,18,23-24,32H2,1H3/b12-8+