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

Systemtic Name: 2-[2-[(6-carbamimidoyl-1H-indol-3-yl)methyl]phenyl]-5-methoxy-benzoic acid Openeye Name: 2-[2-[(6-carbamimidoyl-1H-indol-3-yl)methyl]phenyl]-5-methoxy-benzoic acid CAS Name: 2-[2-[(6-carbamimidoyl-1H-indol-3-yl)methyl]phenyl]-5-methoxybenzoic acid IUPAC Name: 2-[2-[(6-carbamimidoyl-1H-indol-3-yl)methyl]phenyl]-5-methoxybenzoic acid Traditional Name: 2-[2-[(6-amidino-1H-indol-3-yl)methyl]phenyl]-5-methoxy-benzoic acid Formula: C24H21N3O3 MolecularWeight: 399.44184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CC=CC=C2CC3=CNC4=C3C=CC(=C4)C(=N)N)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CC=CC=C2CC3=CNC4=C3C=CC(=C4)C(=N)N)C(=O)O

InChI

InChI=1S/C24H21N3O3/c1-30-17-7-9-20(21(12-17)24(28)29)18-5-3-2-4-14(18)10-16-13-27-22-11-15(23(25)26)6-8-19(16)22/h2-9,11-13,27H,10H2,1H3,(H3,25,26)(H,28,29)