5-aminocarbonyl-2-[3-[(5-carbamimidoyl-2,3-dihydroindol-1-yl)methyl]phenyl]benzoic acid

Systemtic Name: 5-aminocarbonyl-2-[3-[(5-carbamimidoyl-2,3-dihydroindol-1-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[3-[(5-carbamimidoylindolin-1-yl)methyl]phenyl]-5-carbamoyl-benzoic acid CAS Name: 2-[3-[(5-carbamimidoyl-2,3-dihydroindol-1-yl)methyl]phenyl]-5-carbamoylbenzoic acid IUPAC Name: 2-[3-[(5-carbamimidoyl-2,3-dihydroindol-1-yl)methyl]phenyl]-5-carbamoylbenzoic acid Traditional Name: 2-[3-[(5-amidinoindolin-1-yl)methyl]phenyl]-5-carbamoyl-benzoic acid Formula: C24H22N4O3 MolecularWeight: 414.45648

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=C(C=C2)C(=N)N)CC3=CC=CC(=C3)C4=C(C=C(C=C4)C(=O)N)C(=O)O

Isomeric SMILES

C1CN(C2=C1C=C(C=C2)C(=N)N)CC3=CC=CC(=C3)C4=C(C=C(C=C4)C(=O)N)C(=O)O

InChI

InChI=1S/C24H22N4O3/c25-22(26)17-5-7-21-16(11-17)8-9-28(21)13-14-2-1-3-15(10-14)19-6-4-18(23(27)29)12-20(19)24(30)31/h1-7,10-12H,8-9,13H2,(H3,25,26)(H2,27,29)(H,30,31)