2-diethylaminoethyl 4-[3-(1,3-benzodioxol-5-yl)prop-2-enoylamino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[3-(1,3-benzodioxol-5-yl)prop-2-enoylamino]benzoate Openeye Name: 2-diethylaminoethyl 4-[3-(1,3-benzodioxol-5-yl)prop-2-enoylamino]benzoate CAS Name: 4-[[3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[3-(1,3-benzodioxol-5-yl)prop-2-enoylamino]benzoate Traditional Name: 4-[[3-(1,3-benzodioxol-5-yl)acryloyl]amino]benzoic acid 2-diethylaminoethyl ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C23H26N2O5/c1-3-25(4-2)13-14-28-23(27)18-7-9-19(10-8-18)24-22(26)12-6-17-5-11-20-21(15-17)30-16-29-20/h5-12,15H,3-4,13-14,16H2,1-2H3,(H,24,26)