6-[4-(diethylamino)phenyl]-5-propanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 6-[4-(diethylamino)phenyl]-5-propanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: 6-[4-(diethylamino)phenyl]-5-propanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one CAS Name: 6-[4-(diethylamino)phenyl]-5-(1-oxopropyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: 6-[4-(diethylamino)phenyl]-5-propanoyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: 6-[4-(diethylamino)phenyl]-5-propionyl-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Formula: C26H31N3O2 MolecularWeight: 417.54324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(C2=C(CCCC2=O)NC3=CC=CC=C31)C4=CC=C(C=C4)N(CC)CC

Isomeric SMILES

CCC(=O)N1C(C2=C(CCCC2=O)NC3=CC=CC=C31)C4=CC=C(C=C4)N(CC)CC

InChI

InChI=1S/C26H31N3O2/c1-4-24(31)29-22-12-8-7-10-20(22)27-21-11-9-13-23(30)25(21)26(29)18-14-16-19(17-15-18)28(5-2)6-3/h7-8,10,12,14-17,26-27H,4-6,9,11,13H2,1-3H3