methyl 4-[3-[(5-chloranyl-6-oxidanylidene-1-propan-2-yl-pyridazin-4-yl)amino]propoxy]-3-ethyl-benzoate

Systemtic Name: methyl 4-[3-[(5-chloranyl-6-oxidanylidene-1-propan-2-yl-pyridazin-4-yl)amino]propoxy]-3-ethyl-benzoate Openeye Name: methyl 4-[3-[(5-chloro-1-isopropyl-6-oxo-pyridazin-4-yl)amino]propoxy]-3-ethyl-benzoate CAS Name: 4-[3-[(5-chloro-6-oxo-1-propan-2-yl-4-pyridazinyl)amino]propoxy]-3-ethylbenzoic acid methyl ester IUPAC Name: methyl 4-[3-[(5-chloro-6-oxo-1-propan-2-ylpyridazin-4-yl)amino]propoxy]-3-ethylbenzoate Traditional Name: 4-[3-[(5-chloro-1-isopropyl-6-keto-pyridazin-4-yl)amino]propoxy]-3-ethyl-benzoic acid methyl ester Formula: C20H26ClN3O4 MolecularWeight: 407.89114

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C(=O)OC)OCCCNC2=C(C(=O)N(N=C2)C(C)C)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)C(=O)OC)OCCCNC2=C(C(=O)N(N=C2)C(C)C)Cl

InChI

InChI=1S/C20H26ClN3O4/c1-5-14-11-15(20(26)27-4)7-8-17(14)28-10-6-9-22-16-12-23-24(13(2)3)19(25)18(16)21/h7-8,11-13,22H,5-6,9-10H2,1-4H3