7-chloranyl-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one; methyl 2-oxidanylpropanoate

Systemtic Name: 7-chloranyl-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one; methyl 2-oxidanylpropanoate Openeye Name: 7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one; methyl 2-hydroxypropanoate CAS Name: 7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one; 2-hydroxypropanoic acid methyl ester IUPAC Name: 7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one; methyl 2-hydroxypropanoate Traditional Name: 7-chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one; 2-hydroxypropionic acid methyl ester Formula: C20H21ClN2O4 MolecularWeight: 388.84474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)O.CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)OC)O.CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C16H13ClN2O.C4H8O3/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11;1-3(5)4(6)7-2/h2-9H,10H2,1H3;3,5H,1-2H3