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2-[phenyl-[(phenylmethyl)amino]methyl]propanedioic acid

2-[phenyl-[(phenylmethyl)amino]methyl]propanedioic acid

Systemtic Name:2-[phenyl-[(phenylmethyl)amino]methyl]propanedioic acid
Openeye Name:2-[(benzylamino)-phenyl-methyl]propanedioic acid
CAS Name:2-[phenyl-[(phenylmethyl)amino]methyl]propanedioic acid
IUPAC Name:2-[(benzylamino)-phenylmethyl]propanedioic acid
Traditional Name:2-[(benzylamino)-phenyl-methyl]malonic acid
Formula: C17H17NO4
MolecularWeight: 299.32118
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(C2=CC=CC=C2)C(C(=O)O)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)CNC(C2=CC=CC=C2)C(C(=O)O)C(=O)O


InChI

InChI=1S/C17H17NO4/c19-16(20)14(17(21)22)15(13-9-5-2-6-10-13)18-11-12-7-3-1-4-8-12/h1-10,14-15,18H,11H2,(H,19,20)(H,21,22)


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