ethyl 3-[4-(4-carbamimidoylphenyl)butylcarbamoylamino]-2-methyl-propanoate

Systemtic Name: ethyl 3-[4-(4-carbamimidoylphenyl)butylcarbamoylamino]-2-methyl-propanoate Openeye Name: ethyl 3-[4-(4-carbamimidoylphenyl)butylcarbamoylamino]-2-methyl-propanoate CAS Name: 3-[[[4-(4-carbamimidoylphenyl)butylamino]-oxomethyl]amino]-2-methylpropanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(4-carbamimidoylphenyl)butylcarbamoylamino]-2-methylpropanoate Traditional Name: 3-[4-(4-amidinophenyl)butylcarbamoylamino]-2-methyl-propionic acid ethyl ester Formula: C18H28N4O3 MolecularWeight: 348.43992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)CNC(=O)NCCCCC1=CC=C(C=C1)C(=N)N

Isomeric SMILES

CCOC(=O)C(C)CNC(=O)NCCCCC1=CC=C(C=C1)C(=N)N

InChI

InChI=1S/C18H28N4O3/c1-3-25-17(23)13(2)12-22-18(24)21-11-5-4-6-14-7-9-15(10-8-14)16(19)20/h7-10,13H,3-6,11-12H2,1-2H3,(H3,19,20)(H2,21,22,24)