N-[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]-4-[(4-tert-butylphenyl)carbonylamino]-2-chloranyl-benzamide

Systemtic Name: N-[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]-4-[(4-tert-butylphenyl)carbonylamino]-2-chloranyl-benzamide Openeye Name: N-[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-4-[(4-tert-butylbenzoyl)amino]-2-chloro-benzamide CAS Name: N-[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-4-[[(4-tert-butylphenyl)-oxomethyl]amino]-2-chlorobenzamide IUPAC Name: N-[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-4-[(4-tert-butylbenzoyl)amino]-2-chlorobenzamide Traditional Name: N-[4-[(4-aminocyclohexyl)methyl]cyclohexyl]-4-[(4-tert-butylbenzoyl)amino]-2-chloro-benzamide Formula: C31H42ClN3O2 MolecularWeight: 524.13708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)C(=O)NC3CCC(CC3)CC4CCC(CC4)N)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)C(=O)NC3CCC(CC3)CC4CCC(CC4)N)Cl

InChI

InChI=1S/C31H42ClN3O2/c1-31(2,3)23-10-8-22(9-11-23)29(36)35-26-16-17-27(28(32)19-26)30(37)34-25-14-6-21(7-15-25)18-20-4-12-24(33)13-5-20/h8-11,16-17,19-21,24-25H,4-7,12-15,18,33H2,1-3H3,(H,34,37)(H,35,36)