2-[(phenylmethyl)amino]pent-4-enoic acid

Systemtic Name: 2-[(phenylmethyl)amino]pent-4-enoic acid Openeye Name: 2-(benzylamino)pent-4-enoic acid CAS Name: 2-[(phenylmethyl)amino]-4-pentenoic acid IUPAC Name: 2-(benzylamino)pent-4-enoic acid Traditional Name: 2-(benzylamino)pent-4-enoic acid Formula: C12H15NO2 MolecularWeight: 205.253

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C(=O)O)NCC1=CC=CC=C1

Isomeric SMILES

C=CCC(C(=O)O)NCC1=CC=CC=C1

InChI

InChI=1S/C12H15NO2/c1-2-6-11(12(14)15)13-9-10-7-4-3-5-8-10/h2-5,7-8,11,13H,1,6,9H2,(H,14,15)