[4-[(E)-2-cyano-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-5,6,7,8-tetrahydronaphthalen-1-yl] ethanoate

Systemtic Name: [4-[(E)-2-cyano-3-oxidanylidene-3-phenylazanyl-prop-1-enyl]-5,6,7,8-tetrahydronaphthalen-1-yl] ethanoate Openeye Name: [8-[(E)-3-anilino-2-cyano-3-oxo-prop-1-enyl]tetralin-5-yl] acetate CAS Name: acetic acid [4-[(E)-3-anilino-2-cyano-3-oxoprop-1-enyl]-5,6,7,8-tetrahydronaphthalen-1-yl] ester IUPAC Name: [4-[(E)-3-anilino-2-cyano-3-oxoprop-1-enyl]-5,6,7,8-tetrahydronaphthalen-1-yl] acetate Traditional Name: acetic acid [8-[(E)-3-anilino-2-cyano-3-keto-prop-1-enyl]tetralin-5-yl] ester Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C2CCCCC2=C(C=C1)C=C(C#N)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1=C2CCCCC2=C(C=C1)/C=C(\C#N)/C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H20N2O3/c1-15(25)27-21-12-11-16(19-9-5-6-10-20(19)21)13-17(14-23)22(26)24-18-7-3-2-4-8-18/h2-4,7-8,11-13H,5-6,9-10H2,1H3,(H,24,26)/b17-13+