ethyl N-[[2-methyl-5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)phenyl]methyl]carbamate

Systemtic Name: ethyl N-[[2-methyl-5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)phenyl]methyl]carbamate Openeye Name: ethyl N-[[2-methyl-5-(3-methyl-4-oxo-phthalazin-1-yl)phenyl]methyl]carbamate CAS Name: N-[[2-methyl-5-(3-methyl-4-oxo-1-phthalazinyl)phenyl]methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[[2-methyl-5-(3-methyl-4-oxophthalazin-1-yl)phenyl]methyl]carbamate Traditional Name: N-[5-(4-keto-3-methyl-phthalazin-1-yl)-2-methyl-benzyl]carbamic acid ethyl ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NCC1=C(C=CC(=C1)C2=NN(C(=O)C3=CC=CC=C32)C)C

Isomeric SMILES

CCOC(=O)NCC1=C(C=CC(=C1)C2=NN(C(=O)C3=CC=CC=C32)C)C

InChI

InChI=1S/C20H21N3O3/c1-4-26-20(25)21-12-15-11-14(10-9-13(15)2)18-16-7-5-6-8-17(16)19(24)23(3)22-18/h5-11H,4,12H2,1-3H3,(H,21,25)