1-[4-[(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoyl]piperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-[(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoyl]piperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoyl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoyl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)acryloyl]piperazino]-2-methyl-propan-1-one Formula: C18H21ClN2O4 MolecularWeight: 364.82334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C=CC2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)/C=C/C2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C18H21ClN2O4/c1-12(2)18(23)21-7-5-20(6-8-21)16(22)4-3-13-9-14(19)17-15(10-13)24-11-25-17/h3-4,9-10,12H,5-8,11H2,1-2H3/b4-3+