azepan-1-yl-[2-(2,4-dichlorophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-5-yl]methanone

Systemtic Name: azepan-1-yl-[2-(2,4-dichlorophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-5-yl]methanone Openeye Name: azepan-1-yl-[2-(2,4-dichlorophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-5-yl]methanone CAS Name: 1-azepanyl-[2-(2,4-dichlorophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-5-yl]methanone IUPAC Name: azepan-1-yl-[2-(2,4-dichlorophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-5-yl]methanone Traditional Name: azepan-1-yl-[1-(2,4-dichlorophenyl)-5-(4-methoxyphenyl)-2-pyrazolin-3-yl]methanone Formula: C23H25Cl2N3O2 MolecularWeight: 446.3695

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2CC(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)N4CCCCCC4

InChI

InChI=1S/C23H25Cl2N3O2/c1-30-18-9-6-16(7-10-18)22-15-20(23(29)27-12-4-2-3-5-13-27)26-28(22)21-11-8-17(24)14-19(21)25/h6-11,14,22H,2-5,12-13,15H2,1H3