6-[[(1S)-1-(3-benzamidophenyl)ethyl]-methyl-carbamoyl]pyridazin-3-olate

Systemtic Name: 6-[[(1S)-1-(3-benzamidophenyl)ethyl]-methyl-carbamoyl]pyridazin-3-olate Openeye Name: 6-[[(1S)-1-(3-benzamidophenyl)ethyl]-methyl-carbamoyl]pyridazin-3-olate CAS Name: 6-[[[(1S)-1-(3-benzamidophenyl)ethyl]-methylamino]-oxomethyl]-3-pyridazinolate IUPAC Name: 6-[[(1S)-1-(3-benzamidophenyl)ethyl]-methylcarbamoyl]pyridazin-3-olate Traditional Name: 6-[[(1S)-1-(3-benzamidophenyl)ethyl]-methyl-carbamoyl]pyridazin-3-olate Formula: C21H19N4O3- MolecularWeight: 375.40056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)C(=O)C3=NN=C(C=C3)[O-]

Isomeric SMILES

C[C@@H](C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N(C)C(=O)C3=NN=C(C=C3)[O-]

InChI

InChI=1S/C21H20N4O3/c1-14(25(2)21(28)18-11-12-19(26)24-23-18)16-9-6-10-17(13-16)22-20(27)15-7-4-3-5-8-15/h3-14H,1-2H3,(H,22,27)(H,24,26)/p-1/t14-/m0/s1