(2S)-N-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]-1-ethanoyl-5-oxidanylidene-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]-1-ethanoyl-5-oxidanylidene-pyrrolidine-2-carboxamide Openeye Name: (2S)-1-acetyl-N-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]-5-oxo-pyrrolidine-2-carboxamide CAS Name: (2S)-1-acetyl-N-[4-[4-(3-chlorophenyl)-1-piperazinyl]butyl]-5-oxo-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-acetyl-N-[4-[4-(3-chlorophenyl)piperazin-1-yl]butyl]-5-oxopyrrolidine-2-carboxamide Traditional Name: (2S)-1-acetyl-N-[4-[4-(3-chlorophenyl)piperazino]butyl]-5-keto-pyrrolidine-2-carboxamide Formula: C21H29ClN4O3 MolecularWeight: 420.93296

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CCC1=O)C(=O)NCCCCN2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(=O)N1[C@@H](CCC1=O)C(=O)NCCCCN2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H29ClN4O3/c1-16(27)26-19(7-8-20(26)28)21(29)23-9-2-3-10-24-11-13-25(14-12-24)18-6-4-5-17(22)15-18/h4-6,15,19H,2-3,7-14H2,1H3,(H,23,29)/t19-/m0/s1