2-[4-[2-acetamido-3-(1H-indol-3-yl)propanoyl]-1,4-diazepan-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-[2-acetamido-3-(1H-indol-3-yl)propanoyl]-1,4-diazepan-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-[2-acetamido-3-(1H-indol-3-yl)propanoyl]-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[2-acetamido-3-(1H-indol-3-yl)-1-oxopropyl]-1,4-diazepan-1-yl]-N,N-dimethylacetamide IUPAC Name: 2-[4-[2-acetamido-3-(1H-indol-3-yl)propanoyl]-1,4-diazepan-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-[2-acetamido-3-(1H-indol-3-yl)propanoyl]-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide Formula: C22H31N5O3 MolecularWeight: 413.51324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)N3CCCN(CC3)CC(=O)N(C)C

Isomeric SMILES

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)N3CCCN(CC3)CC(=O)N(C)C

InChI

InChI=1S/C22H31N5O3/c1-16(28)24-20(13-17-14-23-19-8-5-4-7-18(17)19)22(30)27-10-6-9-26(11-12-27)15-21(29)25(2)3/h4-5,7-8,14,20,23H,6,9-13,15H2,1-3H3,(H,24,28)