2-[6-[(4-carbamimidoylphenyl)carbamoyl]-3,4-dihydro-2H-chromen-3-yl]ethanoic acid

Systemtic Name: 2-[6-[(4-carbamimidoylphenyl)carbamoyl]-3,4-dihydro-2H-chromen-3-yl]ethanoic acid Openeye Name: 2-[6-[(4-carbamimidoylphenyl)carbamoyl]chroman-3-yl]acetic acid CAS Name: 2-[6-[(4-carbamimidoylanilino)-oxomethyl]-3,4-dihydro-2H-1-benzopyran-3-yl]acetic acid IUPAC Name: 2-[6-[(4-carbamimidoylphenyl)carbamoyl]-3,4-dihydro-2H-chromen-3-yl]acetic acid Traditional Name: 2-[6-[(4-amidinophenyl)carbamoyl]chroman-3-yl]acetic acid Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=N)N)CC(=O)O

Isomeric SMILES

C1C(COC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=N)N)CC(=O)O

InChI

InChI=1S/C19H19N3O4/c20-18(21)12-1-4-15(5-2-12)22-19(25)13-3-6-16-14(9-13)7-11(10-26-16)8-17(23)24/h1-6,9,11H,7-8,10H2,(H3,20,21)(H,22,25)(H,23,24)