(4-carbamimidoylphenyl) 4-[[ethyl-(phenylmethyl)amino]methyl]benzoate

Systemtic Name: (4-carbamimidoylphenyl) 4-[[ethyl-(phenylmethyl)amino]methyl]benzoate Openeye Name: (4-carbamimidoylphenyl) 4-[[benzyl(ethyl)amino]methyl]benzoate CAS Name: 4-[[ethyl-(phenylmethyl)amino]methyl]benzoic acid (4-carbamimidoylphenyl) ester IUPAC Name: (4-carbamimidoylphenyl) 4-[[benzyl(ethyl)amino]methyl]benzoate Traditional Name: 4-[[benzyl(ethyl)amino]methyl]benzoic acid (4-amidinophenyl) ester Formula: C24H25N3O2 MolecularWeight: 387.4742

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)CC2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCN(CC1=CC=CC=C1)CC2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C24H25N3O2/c1-2-27(16-18-6-4-3-5-7-18)17-19-8-10-21(11-9-19)24(28)29-22-14-12-20(13-15-22)23(25)26/h3-15H,2,16-17H2,1H3,(H3,25,26)