[4-[(E)-2-benzamido-3-oxidanylidene-3-(2,4,4-trimethylpentan-2-ylamino)prop-1-enyl]-2-methoxy-phenyl] ethanoate

Systemtic Name: [4-[(E)-2-benzamido-3-oxidanylidene-3-(2,4,4-trimethylpentan-2-ylamino)prop-1-enyl]-2-methoxy-phenyl] ethanoate Openeye Name: [4-[(E)-2-benzamido-3-oxo-3-(1,1,3,3-tetramethylbutylamino)prop-1-enyl]-2-methoxy-phenyl] acetate CAS Name: acetic acid [4-[(E)-2-benzamido-3-oxo-3-(2,4,4-trimethylpentan-2-ylamino)prop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-benzamido-3-oxo-3-(2,4,4-trimethylpentan-2-ylamino)prop-1-enyl]-2-methoxyphenyl] acetate Traditional Name: acetic acid [4-[(E)-2-benzamido-3-keto-3-(1,1,3,3-tetramethylbutylamino)prop-1-enyl]-2-methoxy-phenyl] ester Formula: C27H34N2O5 MolecularWeight: 466.56926

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C=C(C(=O)NC(C)(C)CC(C)(C)C)NC(=O)C2=CC=CC=C2)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)/C=C(\C(=O)NC(C)(C)CC(C)(C)C)/NC(=O)C2=CC=CC=C2)OC

InChI

InChI=1S/C27H34N2O5/c1-18(30)34-22-14-13-19(16-23(22)33-7)15-21(28-24(31)20-11-9-8-10-12-20)25(32)29-27(5,6)17-26(2,3)4/h8-16H,17H2,1-7H3,(H,28,31)(H,29,32)/b21-15+