(2S)-2-acetamido-N-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]butanediamide

Systemtic Name: (2S)-2-acetamido-N-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]butanediamide Openeye Name: (2S)-2-acetamido-N-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]butanediamide CAS Name: (2S)-2-acetamido-N-[4-[4-(3-chlorophenyl)-1-piperazinyl]butyl]butanediamide IUPAC Name: (2S)-2-acetamido-N-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]butanediamide Traditional Name: (2S)-2-acetamido-N-[4-[4-(3-chlorophenyl)piperazino]butyl]succinamide Formula: C20H30ClN5O3 MolecularWeight: 423.9369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)N)C(=O)NCCCCN1CCN(CC1)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(=O)N[C@@H](CC(=O)N)C(=O)NCCCCN1CCN(CC1)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C20H30ClN5O3/c1-15(27)24-18(14-19(22)28)20(29)23-7-2-3-8-25-9-11-26(12-10-25)17-6-4-5-16(21)13-17/h4-6,13,18H,2-3,7-12,14H2,1H3,(H2,22,28)(H,23,29)(H,24,27)/t18-/m0/s1