7,8-diethoxy-5-[4-(3-morpholin-4-ylpropyl)phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 7,8-diethoxy-5-[4-(3-morpholin-4-ylpropyl)phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 7,8-diethoxy-5-[4-(3-morpholinopropyl)phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 7,8-diethoxy-5-[4-[3-(4-morpholinyl)propyl]phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 7,8-diethoxy-5-[4-(3-morpholin-4-ylpropyl)phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 7,8-diethoxy-5-[4-(3-morpholinopropyl)phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NCC(=O)N2)C3=CC=C(C=C3)CCCN4CCOCC4)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NCC(=O)N2)C3=CC=C(C=C3)CCCN4CCOCC4)OCC

InChI

InChI=1S/C26H33N3O4/c1-3-32-23-16-21-22(17-24(23)33-4-2)28-25(30)18-27-26(21)20-9-7-19(8-10-20)6-5-11-29-12-14-31-15-13-29/h7-10,16-17H,3-6,11-15,18H2,1-2H3,(H,28,30)