N-[2-[(4-carbamimidoylphenyl)methylamino]-1-cyclohexyl-2-oxidanylidene-ethyl]-2-cyclohexyl-propanamide; ethanoic acid

Systemtic Name: N-[2-[(4-carbamimidoylphenyl)methylamino]-1-cyclohexyl-2-oxidanylidene-ethyl]-2-cyclohexyl-propanamide; ethanoic acid Openeye Name: acetic acid; N-[2-[(4-carbamimidoylphenyl)methylamino]-1-cyclohexyl-2-oxo-ethyl]-2-cyclohexyl-propanamide CAS Name: acetic acid; N-[2-[(4-carbamimidoylphenyl)methylamino]-1-cyclohexyl-2-oxoethyl]-2-cyclohexylpropanamide IUPAC Name: acetic acid; N-[2-[(4-carbamimidoylphenyl)methylamino]-1-cyclohexyl-2-oxoethyl]-2-cyclohexylpropanamide Traditional Name: acetic acid; N-[2-[(4-amidinobenzyl)amino]-1-cyclohexyl-2-keto-ethyl]-2-cyclohexyl-propionamide Formula: C27H42N4O4 MolecularWeight: 486.64678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)C(=O)NC(C2CCCCC2)C(=O)NCC3=CC=C(C=C3)C(=N)N.CC(=O)O

Isomeric SMILES

CC(C1CCCCC1)C(=O)NC(C2CCCCC2)C(=O)NCC3=CC=C(C=C3)C(=N)N.CC(=O)O

InChI

InChI=1S/C25H38N4O2.C2H4O2/c1-17(19-8-4-2-5-9-19)24(30)29-22(20-10-6-3-7-11-20)25(31)28-16-18-12-14-21(15-13-18)23(26)27;1-2(3)4/h12-15,17,19-20,22H,2-11,16H2,1H3,(H3,26,27)(H,28,31)(H,29,30);1H3,(H,3,4)