4-[4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-phenyl-but-1-enyl]phenoxy]-N-methyl-heptan-3-amine

Systemtic Name: 4-[4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-phenyl-but-1-enyl]phenoxy]-N-methyl-heptan-3-amine Openeye Name: 4-[4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-phenyl-but-1-enyl]phenoxy]-N-methyl-heptan-3-amine CAS Name: 4-[4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-phenylbut-1-enyl]phenoxy]-N-methyl-3-heptanamine IUPAC Name: 4-[4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-phenylbut-1-enyl]phenoxy]-N-methylheptan-3-amine Traditional Name: [2-[4-[(Z)-2-(1,3-benzodioxol-5-yl)-1-phenyl-but-1-enyl]phenoxy]-1-ethyl-pentyl]-methyl-amine Formula: C31H37NO3 MolecularWeight: 471.63038

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC)NC)OC1=CC=C(C=C1)C(=C(CC)C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

CCCC(C(CC)NC)OC1=CC=C(C=C1)/C(=C(/CC)\C2=CC3=C(C=C2)OCO3)/C4=CC=CC=C4

InChI

InChI=1S/C31H37NO3/c1-5-11-28(27(7-3)32-4)35-25-17-14-23(15-18-25)31(22-12-9-8-10-13-22)26(6-2)24-16-19-29-30(20-24)34-21-33-29/h8-10,12-20,27-28,32H,5-7,11,21H2,1-4H3/b31-26-