1-[2-[(4-carbamimidoylphenyl)amino]-2-oxidanylidene-ethyl]indole-2-carboxylic acid

Systemtic Name: 1-[2-[(4-carbamimidoylphenyl)amino]-2-oxidanylidene-ethyl]indole-2-carboxylic acid Openeye Name: 1-[2-(4-carbamimidoylanilino)-2-oxo-ethyl]indole-2-carboxylic acid CAS Name: 1-[2-(4-carbamimidoylanilino)-2-oxoethyl]-2-indolecarboxylic acid IUPAC Name: 1-[2-(4-carbamimidoylanilino)-2-oxoethyl]indole-2-carboxylic acid Traditional Name: 1-[2-(4-amidinoanilino)-2-keto-ethyl]indole-2-carboxylic acid Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2CC(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2CC(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)O

InChI

InChI=1S/C18H16N4O3/c19-17(20)11-5-7-13(8-6-11)21-16(23)10-22-14-4-2-1-3-12(14)9-15(22)18(24)25/h1-9H,10H2,(H3,19,20)(H,21,23)(H,24,25)