(Z)-4-[(3-methoxy-4-oxidanyl-phenyl)methylamino]-4-oxidanyl-but-3-en-2-one

Systemtic Name: (Z)-4-[(3-methoxy-4-oxidanyl-phenyl)methylamino]-4-oxidanyl-but-3-en-2-one Openeye Name: (Z)-4-hydroxy-4-[(4-hydroxy-3-methoxy-phenyl)methylamino]but-3-en-2-one CAS Name: (Z)-4-hydroxy-4-[(4-hydroxy-3-methoxyphenyl)methylamino]-3-buten-2-one IUPAC Name: (Z)-4-hydroxy-4-[(4-hydroxy-3-methoxyphenyl)methylamino]but-3-en-2-one Traditional Name: (Z)-4-hydroxy-4-(vanillylamino)but-3-en-2-one Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)/C=C(/NCC1=CC(=C(C=C1)O)OC)\O

InChI

InChI=1S/C12H15NO4/c1-8(14)5-12(16)13-7-9-3-4-10(15)11(6-9)17-2/h3-6,13,15-16H,7H2,1-2H3/b12-5-