8-chloranyl-1-(cyclopropylmethyl)-5-(3-hydroxyphenyl)-3-propan-2-yl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 8-chloranyl-1-(cyclopropylmethyl)-5-(3-hydroxyphenyl)-3-propan-2-yl-3H-1,4-benzodiazepin-2-one Openeye Name: 8-chloro-1-(cyclopropylmethyl)-5-(3-hydroxyphenyl)-3-isopropyl-3H-1,4-benzodiazepin-2-one CAS Name: 8-chloro-1-(cyclopropylmethyl)-5-(3-hydroxyphenyl)-3-propan-2-yl-3H-1,4-benzodiazepin-2-one IUPAC Name: 8-chloro-1-(cyclopropylmethyl)-5-(3-hydroxyphenyl)-3-propan-2-yl-3H-1,4-benzodiazepin-2-one Traditional Name: 8-chloro-1-(cyclopropylmethyl)-5-(3-hydroxyphenyl)-3-isopropyl-3H-1,4-benzodiazepin-2-one Formula: C22H23ClN2O2 MolecularWeight: 382.88322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C2=C(C=CC(=C2)Cl)C(=N1)C3=CC(=CC=C3)O)CC4CC4

Isomeric SMILES

CC(C)C1C(=O)N(C2=C(C=CC(=C2)Cl)C(=N1)C3=CC(=CC=C3)O)CC4CC4

InChI

InChI=1S/C22H23ClN2O2/c1-13(2)20-22(27)25(12-14-6-7-14)19-11-16(23)8-9-18(19)21(24-20)15-4-3-5-17(26)10-15/h3-5,8-11,13-14,20,26H,6-7,12H2,1-2H3