(2S)-2-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-N-ethyl-propanamide Openeye Name: (2S)-2-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-N-ethyl-propanamide CAS Name: (2S)-2-[[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]amino]-N-ethylpropanamide IUPAC Name: (2S)-2-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-N-ethylpropanamide Traditional Name: (2S)-2-[[(E)-3-(1,3-benzodioxol-5-yl)acryloyl]amino]-N-ethyl-propionamide Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)C=CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)/C=C/C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C15H18N2O4/c1-3-16-15(19)10(2)17-14(18)7-5-11-4-6-12-13(8-11)21-9-20-12/h4-8,10H,3,9H2,1-2H3,(H,16,19)(H,17,18)/b7-5+/t10-/m0/s1