N-[(E)-1-(3-bromophenyl)-3-oxidanylidene-3-(3-oxidanylpropylamino)prop-1-en-2-yl]-4-methyl-benzamide

Systemtic Name: N-[(E)-1-(3-bromophenyl)-3-oxidanylidene-3-(3-oxidanylpropylamino)prop-1-en-2-yl]-4-methyl-benzamide Openeye Name: N-[(E)-2-(3-bromophenyl)-1-(3-hydroxypropylcarbamoyl)vinyl]-4-methyl-benzamide CAS Name: N-[(E)-1-(3-bromophenyl)-3-(3-hydroxypropylamino)-3-oxoprop-1-en-2-yl]-4-methylbenzamide IUPAC Name: N-[(E)-1-(3-bromophenyl)-3-(3-hydroxypropylamino)-3-oxoprop-1-en-2-yl]-4-methylbenzamide Traditional Name: N-[(E)-2-(3-bromophenyl)-1-(3-hydroxypropylcarbamoyl)vinyl]-4-methyl-benzamide Formula: C20H21BrN2O3 MolecularWeight: 417.29634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CC2=CC(=CC=C2)Br)C(=O)NCCCO

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C/C2=CC(=CC=C2)Br)/C(=O)NCCCO

InChI

InChI=1S/C20H21BrN2O3/c1-14-6-8-16(9-7-14)19(25)23-18(20(26)22-10-3-11-24)13-15-4-2-5-17(21)12-15/h2,4-9,12-13,24H,3,10-11H2,1H3,(H,22,26)(H,23,25)/b18-13+