N-[(2-acetamidophenyl)methyl]-N-[[3-(aminomethyl)phenyl]methyl]cyclohexanecarboxamide

Systemtic Name: N-[(2-acetamidophenyl)methyl]-N-[[3-(aminomethyl)phenyl]methyl]cyclohexanecarboxamide Openeye Name: N-[(2-acetamidophenyl)methyl]-N-[[3-(aminomethyl)phenyl]methyl]cyclohexanecarboxamide CAS Name: N-[(2-acetamidophenyl)methyl]-N-[[3-(aminomethyl)phenyl]methyl]cyclohexanecarboxamide IUPAC Name: N-[(2-acetamidophenyl)methyl]-N-[[3-(aminomethyl)phenyl]methyl]cyclohexanecarboxamide Traditional Name: N-(2-acetamidobenzyl)-N-[3-(aminomethyl)benzyl]cyclohexanecarboxamide Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1CN(CC2=CC=CC(=C2)CN)C(=O)C3CCCCC3

Isomeric SMILES

CC(=O)NC1=CC=CC=C1CN(CC2=CC=CC(=C2)CN)C(=O)C3CCCCC3

InChI

InChI=1S/C24H31N3O2/c1-18(28)26-23-13-6-5-12-22(23)17-27(24(29)21-10-3-2-4-11-21)16-20-9-7-8-19(14-20)15-25/h5-9,12-14,21H,2-4,10-11,15-17,25H2,1H3,(H,26,28)