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

Systemtic Name: 2-[3-[(4-carbamimidoylphenyl)methylcarbamoyloxy]-4-methyl-phenoxy]ethanoic acid Openeye Name: 2-[3-[(4-carbamimidoylphenyl)methylcarbamoyloxy]-4-methyl-phenoxy]acetic acid CAS Name: 2-[3-[[(4-carbamimidoylphenyl)methylamino]-oxomethoxy]-4-methylphenoxy]acetic acid IUPAC Name: 2-[3-[(4-carbamimidoylphenyl)methylcarbamoyloxy]-4-methylphenoxy]acetic acid Traditional Name: 2-[3-[(4-amidinobenzyl)carbamoyloxy]-4-methyl-phenoxy]acetic acid Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)O)OC(=O)NCC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)O)OC(=O)NCC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C18H19N3O5/c1-11-2-7-14(25-10-16(22)23)8-15(11)26-18(24)21-9-12-3-5-13(6-4-12)17(19)20/h2-8H,9-10H2,1H3,(H3,19,20)(H,21,24)(H,22,23)