5-[(4-bromanyl-2-methanoyl-phenyl)-(phenylmethyl)amino]pentanoic acid

Systemtic Name: 5-[(4-bromanyl-2-methanoyl-phenyl)-(phenylmethyl)amino]pentanoic acid Openeye Name: 5-(N-benzyl-4-bromo-2-formyl-anilino)pentanoic acid CAS Name: 5-(4-bromo-2-formyl-N-(phenylmethyl)anilino)pentanoic acid IUPAC Name: 5-(N-benzyl-4-bromo-2-formylanilino)pentanoic acid Traditional Name: 5-(N-benzyl-4-bromo-2-formyl-anilino)valeric acid Formula: C19H20BrNO3 MolecularWeight: 390.271

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCCCC(=O)O)C2=C(C=C(C=C2)Br)C=O

Isomeric SMILES

C1=CC=C(C=C1)CN(CCCCC(=O)O)C2=C(C=C(C=C2)Br)C=O

InChI

InChI=1S/C19H20BrNO3/c20-17-9-10-18(16(12-17)14-22)21(11-5-4-8-19(23)24)13-15-6-2-1-3-7-15/h1-3,6-7,9-10,12,14H,4-5,8,11,13H2,(H,23,24)