7-chloranyl-1-(3-oxidanylpropyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-1-(3-oxidanylpropyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-1-(3-hydroxypropyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-1-(3-hydroxypropyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-1-(3-hydroxypropyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-1-(3-hydroxypropyl)-5-phenyl-3-propyl-3H-1,4-benzodiazepin-2-one Formula: C21H23ClN2O2 MolecularWeight: 370.87252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CCCO

Isomeric SMILES

CCCC1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)CCCO

InChI

InChI=1S/C21H23ClN2O2/c1-2-7-18-21(26)24(12-6-13-25)19-11-10-16(22)14-17(19)20(23-18)15-8-4-3-5-9-15/h3-5,8-11,14,18,25H,2,6-7,12-13H2,1H3