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

Systemtic Name: 7-chloranyl-3-oxidanyl-1-(3-oxidanylpropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-3-hydroxy-1-(3-hydroxypropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-3-hydroxy-1-(3-hydroxypropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-3-hydroxy-1-(3-hydroxypropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 7-chloro-3-hydroxy-1-(3-hydroxypropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C18H17ClN2O3 MolecularWeight: 344.79218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=C2C=C(C=C3)Cl)CCCO)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=C2C=C(C=C3)Cl)CCCO)O

InChI

InChI=1S/C18H17ClN2O3/c19-13-7-8-15-14(11-13)16(12-5-2-1-3-6-12)20-17(23)18(24)21(15)9-4-10-22/h1-3,5-8,11,17,22-23H,4,9-10H2