2-[(4-carbamimidoylphenyl)amino]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanoic acid

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanoic acid Openeye Name: 2-(4-carbamimidoylanilino)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetic acid CAS Name: 2-(4-carbamimidoylanilino)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetic acid IUPAC Name: 2-(4-carbamimidoylanilino)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetic acid Traditional Name: 2-(4-amidinoanilino)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetic acid Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(C(=O)O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(C(=O)O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C17H17N3O4/c18-16(19)10-1-4-12(5-2-10)20-15(17(21)22)11-3-6-13-14(9-11)24-8-7-23-13/h1-6,9,15,20H,7-8H2,(H3,18,19)(H,21,22)