ethyl 5-[2-(dipropylamino)ethanoyl]-4-methyl-1,2,3,4-tetrahydro-1,5-benzodiazepine-2-carboxylate

Systemtic Name: ethyl 5-[2-(dipropylamino)ethanoyl]-4-methyl-1,2,3,4-tetrahydro-1,5-benzodiazepine-2-carboxylate Openeye Name: ethyl 5-[2-(dipropylamino)acetyl]-4-methyl-1,2,3,4-tetrahydro-1,5-benzodiazepine-2-carboxylate CAS Name: 5-[2-(dipropylamino)-1-oxoethyl]-4-methyl-1,2,3,4-tetrahydro-1,5-benzodiazepine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(dipropylamino)acetyl]-4-methyl-1,2,3,4-tetrahydro-1,5-benzodiazepine-2-carboxylate Traditional Name: 5-[2-(dipropylamino)acetyl]-4-methyl-1,2,3,4-tetrahydro-1,5-benzodiazepine-2-carboxylic acid ethyl ester Formula: C21H33N3O3 MolecularWeight: 375.50502

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CC(=O)N1C(CC(NC2=CC=CC=C21)C(=O)OCC)C

Isomeric SMILES

CCCN(CCC)CC(=O)N1C(CC(NC2=CC=CC=C21)C(=O)OCC)C

InChI

InChI=1S/C21H33N3O3/c1-5-12-23(13-6-2)15-20(25)24-16(4)14-18(21(26)27-7-3)22-17-10-8-9-11-19(17)24/h8-11,16,18,22H,5-7,12-15H2,1-4H3