ethyl 2-(1,3-benzodioxol-5-yl)-4-methyl-2,3-dihydro-1H-1,5-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 2-(1,3-benzodioxol-5-yl)-4-methyl-2,3-dihydro-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 2-(1,3-benzodioxol-5-yl)-4-methyl-2,3-dihydro-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 2-(1,3-benzodioxol-5-yl)-4-methyl-2,3-dihydro-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzodioxol-5-yl)-4-methyl-2,3-dihydro-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-methyl-2,3-dihydro-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(NC2=CC=CC=C2N=C1C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1C(NC2=CC=CC=C2N=C1C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N2O4/c1-3-24-20(23)18-12(2)21-14-6-4-5-7-15(14)22-19(18)13-8-9-16-17(10-13)26-11-25-16/h4-10,18-19,22H,3,11H2,1-2H3