2-[4-[(4-carbamimidoylphenyl)carbonylcarbamoylamino]-3-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(4-carbamimidoylphenyl)carbonylcarbamoylamino]-3-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[(4-carbamimidoylbenzoyl)carbamoylamino]-3-methyl-phenoxy]acetic acid CAS Name: 2-[4-[[[[(4-carbamimidoylphenyl)-oxomethyl]amino]-oxomethyl]amino]-3-methylphenoxy]acetic acid IUPAC Name: 2-[4-[(4-carbamimidoylbenzoyl)carbamoylamino]-3-methylphenoxy]acetic acid Traditional Name: 2-[4-[(4-amidinobenzoyl)carbamoylamino]-3-methyl-phenoxy]acetic acid Formula: C18H18N4O5 MolecularWeight: 370.35932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)O)NC(=O)NC(=O)C2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)O)NC(=O)NC(=O)C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C18H18N4O5/c1-10-8-13(27-9-15(23)24)6-7-14(10)21-18(26)22-17(25)12-4-2-11(3-5-12)16(19)20/h2-8H,9H2,1H3,(H3,19,20)(H,23,24)(H2,21,22,25,26)