(E)-4-[(3-methoxyphenyl)methyl-propan-2-yl-amino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[(3-methoxyphenyl)methyl-propan-2-yl-amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[isopropyl-[(3-methoxyphenyl)methyl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[(3-methoxyphenyl)methyl-propan-2-ylamino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[(3-methoxyphenyl)methyl-propan-2-ylamino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[isopropyl(m-anisyl)amino]-4-keto-but-2-enoic acid Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC(=CC=C1)OC)C(=O)C=CC(=O)O

Isomeric SMILES

CC(C)N(CC1=CC(=CC=C1)OC)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C15H19NO4/c1-11(2)16(14(17)7-8-15(18)19)10-12-5-4-6-13(9-12)20-3/h4-9,11H,10H2,1-3H3,(H,18,19)/b8-7+