2-chloranyl-N-[3-morpholin-4-ylcarbonyl-4-[4-(phenylmethyl)piperazin-1-yl]phenyl]benzamide

Systemtic Name: 2-chloranyl-N-[3-morpholin-4-ylcarbonyl-4-[4-(phenylmethyl)piperazin-1-yl]phenyl]benzamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)-3-(morpholine-4-carbonyl)phenyl]-2-chloro-benzamide CAS Name: 2-chloro-N-[3-[4-morpholinyl(oxo)methyl]-4-[4-(phenylmethyl)-1-piperazinyl]phenyl]benzamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)-3-(morpholine-4-carbonyl)phenyl]-2-chlorobenzamide Traditional Name: N-[4-(4-benzylpiperazino)-3-(morpholine-4-carbonyl)phenyl]-2-chloro-benzamide Formula: C29H31ClN4O3 MolecularWeight: 519.03444

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4Cl)C(=O)N5CCOCC5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4Cl)C(=O)N5CCOCC5

InChI

InChI=1S/C29H31ClN4O3/c30-26-9-5-4-8-24(26)28(35)31-23-10-11-27(25(20-23)29(36)34-16-18-37-19-17-34)33-14-12-32(13-15-33)21-22-6-2-1-3-7-22/h1-11,20H,12-19,21H2,(H,31,35)