ethyl 3-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 3-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoyl]amino]benzoate Openeye Name: ethyl 3-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoyl]amino]benzoate CAS Name: 3-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-1-oxoprop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enoyl]amino]benzoate Traditional Name: 3-[[(E)-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)acryloyl]amino]benzoic acid ethyl ester Formula: C21H21NO6 MolecularWeight: 383.39454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C=CC2=CC3=C(C(=C2)OC)OCCO3

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)/C=C/C2=CC3=C(C(=C2)OC)OCCO3

InChI

InChI=1S/C21H21NO6/c1-3-26-21(24)15-5-4-6-16(13-15)22-19(23)8-7-14-11-17(25-2)20-18(12-14)27-9-10-28-20/h4-8,11-13H,3,9-10H2,1-2H3,(H,22,23)/b8-7+