aluminum 2-[(2-benzamido-3-phenyl-propanoyl)amino]-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: aluminum 2-[(2-benzamido-3-phenyl-propanoyl)amino]-3-(4-hydroxyphenyl)propanoic acid Openeye Name: aluminum 2-[(2-benzamido-3-phenyl-propanoyl)amino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: aluminum 2-[(2-benzamido-1-oxo-3-phenylpropyl)amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: aluminum 2-[(2-benzamido-3-phenylpropanoyl)amino]-3-(4-hydroxyphenyl)propanoic acid Traditional Name: aluminum 2-[(2-benzamido-3-phenyl-propanoyl)amino]-3-(4-hydroxyphenyl)propionic acid Formula: C25H24AlN2O5+3 MolecularWeight: 459.449998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CC2=CC=C(C=C2)O)C(=O)O)NC(=O)C3=CC=CC=C3.[Al+3]

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC(CC2=CC=C(C=C2)O)C(=O)O)NC(=O)C3=CC=CC=C3.[Al+3]

InChI

InChI=1S/C25H24N2O5.Al/c28-20-13-11-18(12-14-20)16-22(25(31)32)27-24(30)21(15-17-7-3-1-4-8-17)26-23(29)19-9-5-2-6-10-19;/h1-14,21-22,28H,15-16H2,(H,26,29)(H,27,30)(H,31,32);/q;+3