[(3-carbamimidoylphenyl)carbonylamino]methyl 3-phenylpropanoate

Systemtic Name: [(3-carbamimidoylphenyl)carbonylamino]methyl 3-phenylpropanoate Openeye Name: [(3-carbamimidoylbenzoyl)amino]methyl 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [[(3-carbamimidoylphenyl)-oxomethyl]amino]methyl ester IUPAC Name: [(3-carbamimidoylbenzoyl)amino]methyl 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [(3-amidinobenzoyl)amino]methyl ester Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)OCNC(=O)C2=CC=CC(=C2)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)OCNC(=O)C2=CC=CC(=C2)C(=N)N

InChI

InChI=1S/C18H19N3O3/c19-17(20)14-7-4-8-15(11-14)18(23)21-12-24-16(22)10-9-13-5-2-1-3-6-13/h1-8,11H,9-10,12H2,(H3,19,20)(H,21,23)