2,2-bis[(phenylmethyl)amino]butanedioic acid

Systemtic Name: 2,2-bis[(phenylmethyl)amino]butanedioic acid Openeye Name: 2,2-bis(benzylamino)butanedioic acid CAS Name: 2,2-bis[(phenylmethyl)amino]butanedioic acid IUPAC Name: 2,2-bis(benzylamino)butanedioic acid Traditional Name: 2,2-bis(benzylamino)succinic acid Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(CC(=O)O)(C(=O)O)NCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CNC(CC(=O)O)(C(=O)O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O4/c21-16(22)11-18(17(23)24,19-12-14-7-3-1-4-8-14)20-13-15-9-5-2-6-10-15/h1-10,19-20H,11-13H2,(H,21,22)(H,23,24)