2-[3-[4-[(E)-4-chloranyl-1,2-diphenyl-but-1-enyl]phenoxy]propylamino]ethanol

Systemtic Name: 2-[3-[4-[(E)-4-chloranyl-1,2-diphenyl-but-1-enyl]phenoxy]propylamino]ethanol Openeye Name: 2-[3-[4-[(E)-4-chloro-1,2-diphenyl-but-1-enyl]phenoxy]propylamino]ethanol CAS Name: 2-[3-[4-[(E)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]propylamino]ethanol IUPAC Name: 2-[3-[4-[(E)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]propylamino]ethanol Traditional Name: 2-[3-[4-[(E)-4-chloro-1,2-diphenyl-but-1-enyl]phenoxy]propylamino]ethanol Formula: C27H30ClNO2 MolecularWeight: 435.9856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)C3=CC=C(C=C3)OCCCNCCO)CCCl

Isomeric SMILES

C1=CC=C(C=C1)/C(=C(\C2=CC=CC=C2)/C3=CC=C(C=C3)OCCCNCCO)/CCCl

InChI

InChI=1S/C27H30ClNO2/c28-17-16-26(22-8-3-1-4-9-22)27(23-10-5-2-6-11-23)24-12-14-25(15-13-24)31-21-7-18-29-19-20-30/h1-6,8-15,29-30H,7,16-21H2/b27-26+