N1-[(4-carbamimidoylphenyl)methyl]-N2-(phenylmethyl)cyclohex-2-ene-1,2-dicarboxamide

Systemtic Name: N1-[(4-carbamimidoylphenyl)methyl]-N2-(phenylmethyl)cyclohex-2-ene-1,2-dicarboxamide Openeye Name: N2-benzyl-N1-[(4-carbamimidoylphenyl)methyl]cyclohex-2-ene-1,2-dicarboxamide CAS Name: N1-[(4-carbamimidoylphenyl)methyl]-N2-(phenylmethyl)cyclohex-2-ene-1,2-dicarboxamide IUPAC Name: 2-N-benzyl-1-N-[(4-carbamimidoylphenyl)methyl]cyclohex-2-ene-1,2-dicarboxamide Traditional Name: N-(4-amidinobenzyl)-N'-benzyl-cyclohex-2-ene-1,2-dicarboxamide Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C(C1)C(=O)NCC2=CC=C(C=C2)C(=N)N)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CC=C(C(C1)C(=O)NCC2=CC=C(C=C2)C(=N)N)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H26N4O2/c24-21(25)18-12-10-17(11-13-18)15-27-23(29)20-9-5-4-8-19(20)22(28)26-14-16-6-2-1-3-7-16/h1-3,6-8,10-13,20H,4-5,9,14-15H2,(H3,24,25)(H,26,28)(H,27,29)