3-(aminomethyl)-2-azanyl-4-oxidanylidene-4-phenyl-2-(phenylcarbonyl)butanoic acid

Systemtic Name: 3-(aminomethyl)-2-azanyl-4-oxidanylidene-4-phenyl-2-(phenylcarbonyl)butanoic acid Openeye Name: 2-amino-3-(aminomethyl)-2-benzoyl-4-oxo-4-phenyl-butanoic acid CAS Name: 2-amino-3-(aminomethyl)-2-benzoyl-4-oxo-4-phenylbutanoic acid IUPAC Name: 2-amino-3-(aminomethyl)-2-benzoyl-4-oxo-4-phenylbutanoic acid Traditional Name: 2-amino-3-(aminomethyl)-2-benzoyl-4-keto-4-phenyl-butyric acid Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(CN)C(C(=O)C2=CC=CC=C2)(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C(CN)C(C(=O)C2=CC=CC=C2)(C(=O)O)N

InChI

InChI=1S/C18H18N2O4/c19-11-14(15(21)12-7-3-1-4-8-12)18(20,17(23)24)16(22)13-9-5-2-6-10-13/h1-10,14H,11,19-20H2,(H,23,24)