2-[4-[(6-carbamimidoyl-1-methyl-indol-2-yl)carbonylamino]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(6-carbamimidoyl-1-methyl-indol-2-yl)carbonylamino]phenoxy]ethanoic acid Openeye Name: 2-[4-[(6-carbamimidoyl-1-methyl-indole-2-carbonyl)amino]phenoxy]acetic acid CAS Name: 2-[4-[[(6-carbamimidoyl-1-methyl-2-indolyl)-oxomethyl]amino]phenoxy]acetic acid IUPAC Name: 2-[4-[(6-carbamimidoyl-1-methylindole-2-carbonyl)amino]phenoxy]acetic acid Traditional Name: 2-[4-[(6-amidino-1-methyl-indole-2-carbonyl)amino]phenoxy]acetic acid Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C1C=C(C=C2)C(=N)N)C(=O)NC3=CC=C(C=C3)OCC(=O)O

Isomeric SMILES

CN1C(=CC2=C1C=C(C=C2)C(=N)N)C(=O)NC3=CC=C(C=C3)OCC(=O)O

InChI

InChI=1S/C19H18N4O4/c1-23-15-9-12(18(20)21)3-2-11(15)8-16(23)19(26)22-13-4-6-14(7-5-13)27-10-17(24)25/h2-9H,10H2,1H3,(H3,20,21)(H,22,26)(H,24,25)