2-[2-[(6-carbamimidoyl-2,3-dihydroindol-1-yl)methyl]phenyl]benzoic acid

Systemtic Name: 2-[2-[(6-carbamimidoyl-2,3-dihydroindol-1-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[2-[(6-carbamimidoylindolin-1-yl)methyl]phenyl]benzoic acid CAS Name: 2-[2-[(6-carbamimidoyl-2,3-dihydroindol-1-yl)methyl]phenyl]benzoic acid IUPAC Name: 2-[2-[(6-carbamimidoyl-2,3-dihydroindol-1-yl)methyl]phenyl]benzoic acid Traditional Name: 2-[2-[(6-amidinoindolin-1-yl)methyl]phenyl]benzoic acid Formula: C23H21N3O2 MolecularWeight: 371.43174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=CC(=C2)C(=N)N)CC3=CC=CC=C3C4=CC=CC=C4C(=O)O

Isomeric SMILES

C1CN(C2=C1C=CC(=C2)C(=N)N)CC3=CC=CC=C3C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C23H21N3O2/c24-22(25)16-10-9-15-11-12-26(21(15)13-16)14-17-5-1-2-6-18(17)19-7-3-4-8-20(19)23(27)28/h1-10,13H,11-12,14H2,(H3,24,25)(H,27,28)