(E)-4-[butyl-(phenylmethyl)amino]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-[butyl-(phenylmethyl)amino]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-[benzyl(butyl)amino]-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: (E)-4-[butyl-(phenylmethyl)amino]-4-hydroxy-2-oxo-3-butenoic acid IUPAC Name: (E)-4-[benzyl(butyl)amino]-4-hydroxy-2-oxobut-3-enoic acid Traditional Name: (E)-4-[benzyl(butyl)amino]-4-hydroxy-2-keto-but-3-enoic acid Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1)C(=CC(=O)C(=O)O)O

Isomeric SMILES

CCCCN(CC1=CC=CC=C1)/C(=C\C(=O)C(=O)O)/O

InChI

InChI=1S/C15H19NO4/c1-2-3-9-16(11-12-7-5-4-6-8-12)14(18)10-13(17)15(19)20/h4-8,10,18H,2-3,9,11H2,1H3,(H,19,20)/b14-10+