N-(4-iodanyl-2-methyl-phenyl)-1-[(3-methylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-(4-iodanyl-2-methyl-phenyl)-1-[(3-methylphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-(4-iodo-2-methyl-phenyl)-1-(m-tolylmethyl)piperidine-4-carboxamide CAS Name: N-(4-iodo-2-methylphenyl)-1-[(3-methylphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-(4-iodo-2-methylphenyl)-1-[(3-methylphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-(4-iodo-2-methyl-phenyl)-1-(3-methylbenzyl)isonipecotamide Formula: C21H25IN2O MolecularWeight: 448.34047

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCC(CC2)C(=O)NC3=C(C=C(C=C3)I)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCC(CC2)C(=O)NC3=C(C=C(C=C3)I)C

InChI

InChI=1S/C21H25IN2O/c1-15-4-3-5-17(12-15)14-24-10-8-18(9-11-24)21(25)23-20-7-6-19(22)13-16(20)2/h3-7,12-13,18H,8-11,14H2,1-2H3,(H,23,25)