(2S)-2,3-bis[(phenylmethyl)amino]butanedioic acid

Systemtic Name: (2S)-2,3-bis[(phenylmethyl)amino]butanedioic acid Openeye Name: (2S)-2,3-bis(benzylamino)butanedioic acid CAS Name: (2S)-2,3-bis[(phenylmethyl)amino]butanedioic acid IUPAC Name: (2S)-2,3-bis(benzylamino)butanedioic acid Traditional Name: (2S)-2,3-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(C(C(=O)O)NCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN[C@@H](C(C(=O)O)NCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H20N2O4/c21-17(22)15(19-11-13-7-3-1-4-8-13)16(18(23)24)20-12-14-9-5-2-6-10-14/h1-10,15-16,19-20H,11-12H2,(H,21,22)(H,23,24)/t15-,16?/m0/s1