N-[(1R)-1-(3-bromanyl-4-methoxy-phenyl)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(1R)-1-(3-bromanyl-4-methoxy-phenyl)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(1R)-1-(3-bromo-4-methoxy-phenyl)ethyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(1R)-1-(3-bromo-4-methoxyphenyl)ethyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(1R)-1-(3-bromo-4-methoxyphenyl)ethyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(1R)-1-(3-bromo-4-methoxy-phenyl)ethyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C19H18BrN3O3 MolecularWeight: 416.26852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)Br)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

C[C@H](C1=CC(=C(C=C1)OC)Br)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C19H18BrN3O3/c1-11(12-8-9-16(26-3)15(20)10-12)21-18(24)17-13-6-4-5-7-14(13)19(25)23(2)22-17/h4-11H,1-3H3,(H,21,24)/t11-/m1/s1