(E)-14-chloranyl-1-[1H-indol-3-ylmethyl-[(4-methoxyphenyl)methyl]amino]tetradec-3-en-9-yn-5-one

Systemtic Name: (E)-14-chloranyl-1-[1H-indol-3-ylmethyl-[(4-methoxyphenyl)methyl]amino]tetradec-3-en-9-yn-5-one Openeye Name: (E)-14-chloro-1-[1H-indol-3-ylmethyl-[(4-methoxyphenyl)methyl]amino]tetradec-3-en-9-yn-5-one CAS Name: (E)-14-chloro-1-[1H-indol-3-ylmethyl-[(4-methoxyphenyl)methyl]amino]-5-tetradec-3-en-9-ynone IUPAC Name: (E)-14-chloro-1-[1H-indol-3-ylmethyl-[(4-methoxyphenyl)methyl]amino]tetradec-3-en-9-yn-5-one Traditional Name: (E)-14-chloro-1-[1H-indol-3-ylmethyl(p-anisyl)amino]tetradec-3-en-9-yn-5-one Formula: C31H37ClN2O2 MolecularWeight: 505.09068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CCC=CC(=O)CCCC#CCCCCCl)CC2=CNC3=CC=CC=C32

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC/C=C/C(=O)CCCC#CCCCCCl)CC2=CNC3=CC=CC=C32

InChI

InChI=1S/C31H37ClN2O2/c1-36-29-19-17-26(18-20-29)24-34(25-27-23-33-31-16-9-8-15-30(27)31)22-12-10-14-28(35)13-7-5-3-2-4-6-11-21-32/h8-10,14-20,23,33H,4-7,11-13,21-22,24-25H2,1H3/b14-10+