2-[2-[(6-carbamimidoyl-1-ethyl-indazol-3-yl)methyl]phenyl]-5-methoxy-benzoic acid

Systemtic Name: 2-[2-[(6-carbamimidoyl-1-ethyl-indazol-3-yl)methyl]phenyl]-5-methoxy-benzoic acid Openeye Name: 2-[2-[(6-carbamimidoyl-1-ethyl-indazol-3-yl)methyl]phenyl]-5-methoxy-benzoic acid CAS Name: 2-[2-[(6-carbamimidoyl-1-ethyl-3-indazolyl)methyl]phenyl]-5-methoxybenzoic acid IUPAC Name: 2-[2-[(6-carbamimidoyl-1-ethylindazol-3-yl)methyl]phenyl]-5-methoxybenzoic acid Traditional Name: 2-[2-[(6-amidino-1-ethyl-indazol-3-yl)methyl]phenyl]-5-methoxy-benzoic acid Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C(=N)N)C(=N1)CC3=CC=CC=C3C4=C(C=C(C=C4)OC)C(=O)O

Isomeric SMILES

CCN1C2=C(C=CC(=C2)C(=N)N)C(=N1)CC3=CC=CC=C3C4=C(C=C(C=C4)OC)C(=O)O

InChI

InChI=1S/C25H24N4O3/c1-3-29-23-13-16(24(26)27)8-10-20(23)22(28-29)12-15-6-4-5-7-18(15)19-11-9-17(32-2)14-21(19)25(30)31/h4-11,13-14H,3,12H2,1-2H3,(H3,26,27)(H,30,31)