2-[4-[(6-carbamimidoyl-1H-indol-2-yl)carbonylamino]cyclohexyl]oxyethanoic acid

Systemtic Name: 2-[4-[(6-carbamimidoyl-1H-indol-2-yl)carbonylamino]cyclohexyl]oxyethanoic acid Openeye Name: 2-[4-[(6-carbamimidoyl-1H-indole-2-carbonyl)amino]cyclohexoxy]acetic acid CAS Name: 2-[4-[[(6-carbamimidoyl-1H-indol-2-yl)-oxomethyl]amino]cyclohexyl]oxyacetic acid IUPAC Name: 2-[4-[(6-carbamimidoyl-1H-indole-2-carbonyl)amino]cyclohexyl]oxyacetic acid Traditional Name: 2-[4-[(6-amidino-1H-indole-2-carbonyl)amino]cyclohexoxy]acetic acid Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC(=O)C2=CC3=C(N2)C=C(C=C3)C(=N)N)OCC(=O)O

Isomeric SMILES

C1CC(CCC1NC(=O)C2=CC3=C(N2)C=C(C=C3)C(=N)N)OCC(=O)O

InChI

InChI=1S/C18H22N4O4/c19-17(20)11-2-1-10-7-15(22-14(10)8-11)18(25)21-12-3-5-13(6-4-12)26-9-16(23)24/h1-2,7-8,12-13,22H,3-6,9H2,(H3,19,20)(H,21,25)(H,23,24)