[4-[(E)-2-acetamido-3-oxidanylidene-3-(prop-2-enylamino)prop-1-enyl]phenyl] ethanoate

Systemtic Name: [4-[(E)-2-acetamido-3-oxidanylidene-3-(prop-2-enylamino)prop-1-enyl]phenyl] ethanoate Openeye Name: [4-[(E)-2-acetamido-3-(allylamino)-3-oxo-prop-1-enyl]phenyl] acetate CAS Name: acetic acid [4-[(E)-2-acetamido-3-oxo-3-(prop-2-enylamino)prop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-2-acetamido-3-oxo-3-(prop-2-enylamino)prop-1-enyl]phenyl] acetate Traditional Name: acetic acid [4-[(E)-2-acetamido-3-(allylamino)-3-keto-prop-1-enyl]phenyl] ester Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=CC1=CC=C(C=C1)OC(=O)C)C(=O)NCC=C

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4/c1-4-9-17-16(21)15(18-11(2)19)10-13-5-7-14(8-6-13)22-12(3)20/h4-8,10H,1,9H2,2-3H3,(H,17,21)(H,18,19)/b15-10+