3-(3-carbamimidoylphenyl)-5-[(4-propan-2-ylphenoxy)methyl]benzoic acid

Systemtic Name: 3-(3-carbamimidoylphenyl)-5-[(4-propan-2-ylphenoxy)methyl]benzoic acid Openeye Name: 3-(3-carbamimidoylphenyl)-5-[(4-isopropylphenoxy)methyl]benzoic acid CAS Name: 3-(3-carbamimidoylphenyl)-5-[(4-propan-2-ylphenoxy)methyl]benzoic acid IUPAC Name: 3-(3-carbamimidoylphenyl)-5-[(4-propan-2-ylphenoxy)methyl]benzoic acid Traditional Name: 3-(3-amidinophenyl)-5-[(4-isopropylphenoxy)methyl]benzoic acid Formula: C24H24N2O3 MolecularWeight: 388.45896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC2=CC(=CC(=C2)C(=O)O)C3=CC(=CC=C3)C(=N)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC2=CC(=CC(=C2)C(=O)O)C3=CC(=CC=C3)C(=N)N

InChI

InChI=1S/C24H24N2O3/c1-15(2)17-6-8-22(9-7-17)29-14-16-10-20(13-21(11-16)24(27)28)18-4-3-5-19(12-18)23(25)26/h3-13,15H,14H2,1-2H3,(H3,25,26)(H,27,28)