[2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 3-(1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 3-(1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 3-(1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: 3-(1,3-benzodioxol-5-yl)-2-propenoic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 3-(1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: 3-(1,3-benzodioxol-5-yl)acrylic acid [2-keto-2-(3-phenylpropylamino)ethyl] ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CC(=O)OCC(=O)NCCCC3=CC=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C=CC(=O)OCC(=O)NCCCC3=CC=CC=C3

InChI

InChI=1S/C21H21NO5/c23-20(22-12-4-7-16-5-2-1-3-6-16)14-25-21(24)11-9-17-8-10-18-19(13-17)27-15-26-18/h1-3,5-6,8-11,13H,4,7,12,14-15H2,(H,22,23)