2-[1-(1,4-diazepin-1-yl)ethoxy]-4-(6-methylpyridazin-3-yl)cyclohexane-1-carboxylic acid

Systemtic Name: 2-[1-(1,4-diazepin-1-yl)ethoxy]-4-(6-methylpyridazin-3-yl)cyclohexane-1-carboxylic acid Openeye Name: 2-[1-(1,4-diazepin-1-yl)ethoxy]-4-(6-methylpyridazin-3-yl)cyclohexanecarboxylic acid CAS Name: 2-[1-(1,4-diazepin-1-yl)ethoxy]-4-(6-methyl-3-pyridazinyl)-1-cyclohexanecarboxylic acid IUPAC Name: 2-[1-(1,4-diazepin-1-yl)ethoxy]-4-(6-methylpyridazin-3-yl)cyclohexane-1-carboxylic acid Traditional Name: 2-[1-(1,4-diazepin-1-yl)ethoxy]-4-(6-methylpyridazin-3-yl)cyclohexanecarboxylic acid Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C=C1)C2CCC(C(C2)OC(C)N3C=CC=NC=C3)C(=O)O

Isomeric SMILES

CC1=NN=C(C=C1)C2CCC(C(C2)OC(C)N3C=CC=NC=C3)C(=O)O

InChI

InChI=1S/C19H24N4O3/c1-13-4-7-17(22-21-13)15-5-6-16(19(24)25)18(12-15)26-14(2)23-10-3-8-20-9-11-23/h3-4,7-11,14-16,18H,5-6,12H2,1-2H3,(H,24,25)