methyl (E)-3-[[3-(butanoylamino)phenyl]amino]-2-cyano-prop-2-enoate

Systemtic Name: methyl (E)-3-[[3-(butanoylamino)phenyl]amino]-2-cyano-prop-2-enoate Openeye Name: methyl (E)-3-[3-(butanoylamino)anilino]-2-cyano-prop-2-enoate CAS Name: (E)-2-cyano-3-[3-(1-oxobutylamino)anilino]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[3-(butanoylamino)anilino]-2-cyanoprop-2-enoate Traditional Name: (E)-3-(3-butyramidoanilino)-2-cyano-acrylic acid methyl ester Formula: C15H17N3O3 MolecularWeight: 287.31378

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=CC(=C1)NC=C(C#N)C(=O)OC

Isomeric SMILES

CCCC(=O)NC1=CC=CC(=C1)N/C=C(\C#N)/C(=O)OC

InChI

InChI=1S/C15H17N3O3/c1-3-5-14(19)18-13-7-4-6-12(8-13)17-10-11(9-16)15(20)21-2/h4,6-8,10,17H,3,5H2,1-2H3,(H,18,19)/b11-10+