N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[(4-tert-butylphenyl)carbonylamino]-2-chloranyl-benzamide

Systemtic Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[(4-tert-butylphenyl)carbonylamino]-2-chloranyl-benzamide Openeye Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[(4-tert-butylbenzoyl)amino]-2-chloro-benzamide CAS Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[[(4-tert-butylphenyl)-oxomethyl]amino]-2-chlorobenzamide IUPAC Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[(4-tert-butylbenzoyl)amino]-2-chlorobenzamide Traditional Name: N-[[3-(aminomethyl)cyclohexyl]methyl]-4-[(4-tert-butylbenzoyl)amino]-2-chloro-benzamide Formula: C26H34ClN3O2 MolecularWeight: 456.02006

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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)NCC3CCCC(C3)CN)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)C(=O)NCC3CCCC(C3)CN)Cl

InChI

InChI=1S/C26H34ClN3O2/c1-26(2,3)20-9-7-19(8-10-20)24(31)30-21-11-12-22(23(27)14-21)25(32)29-16-18-6-4-5-17(13-18)15-28/h7-12,14,17-18H,4-6,13,15-16,28H2,1-3H3,(H,29,32)(H,30,31)