4-(butanoylamino)-N-[(E)-[(5R)-2-methyl-5-prop-1-en-2-yl-cyclohex-2-en-1-ylidene]amino]benzamide

Systemtic Name: 4-(butanoylamino)-N-[(E)-[(5R)-2-methyl-5-prop-1-en-2-yl-cyclohex-2-en-1-ylidene]amino]benzamide Openeye Name: 4-(butanoylamino)-N-[(E)-[(5R)-5-isopropenyl-2-methyl-cyclohex-2-en-1-ylidene]amino]benzamide CAS Name: N-[(E)-[(5R)-2-methyl-5-(1-methylethenyl)-1-cyclohex-2-enylidene]amino]-4-(1-oxobutylamino)benzamide IUPAC Name: 4-(butanoylamino)-N-[(E)-[(5R)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-ylidene]amino]benzamide Traditional Name: 4-butyramido-N-[(E)-[(5R)-5-isopropenyl-2-methyl-cyclohex-2-en-1-ylidene]amino]benzamide Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)NN=C2CC(CC=C2C)C(=C)C

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)N/N=C/2\C[C@@H](CC=C2C)C(=C)C

InChI

InChI=1S/C21H27N3O2/c1-5-6-20(25)22-18-11-9-16(10-12-18)21(26)24-23-19-13-17(14(2)3)8-7-15(19)4/h7,9-12,17H,2,5-6,8,13H2,1,3-4H3,(H,22,25)(H,24,26)/b23-19+/t17-/m1/s1