N-[5-butoxy-2-(3-cyano-3-oxidanylidene-prop-1-en-2-yl)phenyl]butanamide

Systemtic Name: N-[5-butoxy-2-(3-cyano-3-oxidanylidene-prop-1-en-2-yl)phenyl]butanamide Openeye Name: 2-[2-(butanoylamino)-4-butoxy-phenyl]prop-2-enoyl cyanide CAS Name: N-[5-butoxy-2-(3-cyano-3-oxoprop-1-en-2-yl)phenyl]butanamide IUPAC Name: 2-[2-(butanoylamino)-4-butoxyphenyl]prop-2-enoyl cyanide Traditional Name: N-[5-butoxy-2-(1-carbonocyanidoylvinyl)phenyl]butyramide Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1)C(=C)C(=O)C#N)NC(=O)CCC

Isomeric SMILES

CCCCOC1=CC(=C(C=C1)C(=C)C(=O)C#N)NC(=O)CCC

InChI

InChI=1S/C18H22N2O3/c1-4-6-10-23-14-8-9-15(13(3)17(21)12-19)16(11-14)20-18(22)7-5-2/h8-9,11H,3-7,10H2,1-2H3,(H,20,22)