N-methyl-4-[(E)-3-[[4-(3-methylbutanoylamino)phenyl]amino]-3-oxidanylidene-prop-1-enyl]benzamide

Systemtic Name: N-methyl-4-[(E)-3-[[4-(3-methylbutanoylamino)phenyl]amino]-3-oxidanylidene-prop-1-enyl]benzamide Openeye Name: N-methyl-4-[(E)-3-[4-(3-methylbutanoylamino)anilino]-3-oxo-prop-1-enyl]benzamide CAS Name: N-methyl-4-[(E)-3-[4-[(3-methyl-1-oxobutyl)amino]anilino]-3-oxoprop-1-enyl]benzamide IUPAC Name: N-methyl-4-[(E)-3-[4-(3-methylbutanoylamino)anilino]-3-oxoprop-1-enyl]benzamide Traditional Name: 4-[(E)-3-[4-(isovalerylamino)anilino]-3-keto-prop-1-enyl]-N-methyl-benzamide Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)C(=O)NC

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)/C=C/C2=CC=C(C=C2)C(=O)NC

InChI

InChI=1S/C22H25N3O3/c1-15(2)14-21(27)25-19-11-9-18(10-12-19)24-20(26)13-6-16-4-7-17(8-5-16)22(28)23-3/h4-13,15H,14H2,1-3H3,(H,23,28)(H,24,26)(H,25,27)/b13-6+