4-chloranyl-N-[3-[(E)-2-cyano-3-oxidanylidene-3-(propan-2-ylamino)prop-1-enyl]phenyl]benzamide

Systemtic Name: 4-chloranyl-N-[3-[(E)-2-cyano-3-oxidanylidene-3-(propan-2-ylamino)prop-1-enyl]phenyl]benzamide Openeye Name: 4-chloro-N-[3-[(E)-2-cyano-3-(isopropylamino)-3-oxo-prop-1-enyl]phenyl]benzamide CAS Name: 4-chloro-N-[3-[(E)-2-cyano-3-oxo-3-(propan-2-ylamino)prop-1-enyl]phenyl]benzamide IUPAC Name: 4-chloro-N-[3-[(E)-2-cyano-3-oxo-3-(propan-2-ylamino)prop-1-enyl]phenyl]benzamide Traditional Name: 4-chloro-N-[3-[(E)-2-cyano-3-(isopropylamino)-3-keto-prop-1-enyl]phenyl]benzamide Formula: C20H18ClN3O2 MolecularWeight: 367.82882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)Cl)/C#N

InChI

InChI=1S/C20H18ClN3O2/c1-13(2)23-20(26)16(12-22)10-14-4-3-5-18(11-14)24-19(25)15-6-8-17(21)9-7-15/h3-11,13H,1-2H3,(H,23,26)(H,24,25)/b16-10+