2-[1-[3-[(4-carbamimidoylphenyl)amino]-3-oxidanylidene-propyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[1-[3-[(4-carbamimidoylphenyl)amino]-3-oxidanylidene-propyl]cyclohexyl]ethanoic acid Openeye Name: 2-[1-[3-(4-carbamimidoylanilino)-3-oxo-propyl]cyclohexyl]acetic acid CAS Name: 2-[1-[3-(4-carbamimidoylanilino)-3-oxopropyl]cyclohexyl]acetic acid IUPAC Name: 2-[1-[3-(4-carbamimidoylanilino)-3-oxopropyl]cyclohexyl]acetic acid Traditional Name: 2-[1-[3-(4-amidinoanilino)-3-keto-propyl]cyclohexyl]acetic acid Formula: C18H25N3O3 MolecularWeight: 331.4094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CCC(=O)NC2=CC=C(C=C2)C(=N)N)CC(=O)O

Isomeric SMILES

C1CCC(CC1)(CCC(=O)NC2=CC=C(C=C2)C(=N)N)CC(=O)O

InChI

InChI=1S/C18H25N3O3/c19-17(20)13-4-6-14(7-5-13)21-15(22)8-11-18(12-16(23)24)9-2-1-3-10-18/h4-7H,1-3,8-12H2,(H3,19,20)(H,21,22)(H,23,24)