5-[[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]amino]-4-chloranyl-2-phenyl-pyridazin-3-one

Systemtic Name: 5-[[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]amino]-4-chloranyl-2-phenyl-pyridazin-3-one Openeye Name: 5-[[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]amino]-4-chloro-2-phenyl-pyridazin-3-one CAS Name: 5-[[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]amino]-4-chloro-2-phenyl-3-pyridazinone IUPAC Name: 5-[[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]amino]-4-chloro-2-phenylpyridazin-3-one Traditional Name: 5-[[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]amino]-4-chloro-2-phenyl-pyridazin-3-one Formula: C19H16ClN3O3 MolecularWeight: 369.80164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCO2)NC3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C19H16ClN3O3/c1-12(13-7-8-16-17(9-13)26-11-25-16)22-15-10-21-23(19(24)18(15)20)14-5-3-2-4-6-14/h2-10,12,22H,11H2,1H3/t12-/m0/s1