(E)-3-(3-methoxyphenyl)-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]prop-2-enamide

Systemtic Name: (E)-3-(3-methoxyphenyl)-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]prop-2-enamide Openeye Name: (E)-3-(3-methoxyphenyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]prop-2-enamide CAS Name: (E)-3-(3-methoxyphenyl)-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]-2-propenamide IUPAC Name: (E)-3-(3-methoxyphenyl)-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]prop-2-enamide Traditional Name: (E)-N-[4-(3-ketopiperazino)benzyl]-3-(3-methoxyphenyl)acrylamide Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=CC(=O)NCC2=CC=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

COC1=CC=CC(=C1)/C=C/C(=O)NCC2=CC=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C21H23N3O3/c1-27-19-4-2-3-16(13-19)7-10-20(25)23-14-17-5-8-18(9-6-17)24-12-11-22-21(26)15-24/h2-10,13H,11-12,14-15H2,1H3,(H,22,26)(H,23,25)/b10-7+