2-[(4-carbamimidoylphenyl)amino]-2-[4,5-diethoxy-2-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]ethanoic acid

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-[4,5-diethoxy-2-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]ethanoic acid Openeye Name: 2-(4-carbamimidoylanilino)-2-[4,5-diethoxy-2-(2-ethoxy-2-oxo-ethoxy)phenyl]acetic acid CAS Name: 2-(4-carbamimidoylanilino)-2-[4,5-diethoxy-2-(2-ethoxy-2-oxoethoxy)phenyl]acetic acid IUPAC Name: 2-(4-carbamimidoylanilino)-2-[4,5-diethoxy-2-(2-ethoxy-2-oxoethoxy)phenyl]acetic acid Traditional Name: 2-(4-amidinoanilino)-2-[4,5-diethoxy-2-(2-ethoxy-2-keto-ethoxy)phenyl]acetic acid Formula: C23H29N3O7 MolecularWeight: 459.49226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(C(=O)O)NC2=CC=C(C=C2)C(=N)N)OCC(=O)OCC)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(C(=O)O)NC2=CC=C(C=C2)C(=N)N)OCC(=O)OCC)OCC

InChI

InChI=1S/C23H29N3O7/c1-4-30-18-11-16(17(12-19(18)31-5-2)33-13-20(27)32-6-3)21(23(28)29)26-15-9-7-14(8-10-15)22(24)25/h7-12,21,26H,4-6,13H2,1-3H3,(H3,24,25)(H,28,29)