5-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]-N-cyclohexyl-2-[4-(phenylmethyl)piperazin-1-yl]benzamide

Systemtic Name: 5-[(3-chloranyl-2,2-dimethyl-propanoyl)amino]-N-cyclohexyl-2-[4-(phenylmethyl)piperazin-1-yl]benzamide Openeye Name: 2-(4-benzylpiperazin-1-yl)-5-[(3-chloro-2,2-dimethyl-propanoyl)amino]-N-cyclohexyl-benzamide CAS Name: 5-[(3-chloro-2,2-dimethyl-1-oxopropyl)amino]-N-cyclohexyl-2-[4-(phenylmethyl)-1-piperazinyl]benzamide IUPAC Name: 2-(4-benzylpiperazin-1-yl)-5-[(3-chloro-2,2-dimethylpropanoyl)amino]-N-cyclohexylbenzamide Traditional Name: 2-(4-benzylpiperazino)-5-[(3-chloro-2,2-dimethyl-propanoyl)amino]-N-cyclohexyl-benzamide Formula: C29H39ClN4O2 MolecularWeight: 511.09856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCl)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)C(=O)NC4CCCCC4

Isomeric SMILES

CC(C)(CCl)C(=O)NC1=CC(=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3)C(=O)NC4CCCCC4

InChI

InChI=1S/C29H39ClN4O2/c1-29(2,21-30)28(36)32-24-13-14-26(25(19-24)27(35)31-23-11-7-4-8-12-23)34-17-15-33(16-18-34)20-22-9-5-3-6-10-22/h3,5-6,9-10,13-14,19,23H,4,7-8,11-12,15-18,20-21H2,1-2H3,(H,31,35)(H,32,36)