azepan-1-yl-[2-(1,3-benzodioxol-5-yl)-7-chloranyl-8-methyl-quinolin-4-yl]methanone

Systemtic Name: azepan-1-yl-[2-(1,3-benzodioxol-5-yl)-7-chloranyl-8-methyl-quinolin-4-yl]methanone Openeye Name: azepan-1-yl-[2-(1,3-benzodioxol-5-yl)-7-chloro-8-methyl-4-quinolyl]methanone CAS Name: 1-azepanyl-[2-(1,3-benzodioxol-5-yl)-7-chloro-8-methyl-4-quinolinyl]methanone IUPAC Name: azepan-1-yl-[2-(1,3-benzodioxol-5-yl)-7-chloro-8-methylquinolin-4-yl]methanone Traditional Name: azepan-1-yl-[2-(1,3-benzodioxol-5-yl)-7-chloro-8-methyl-4-quinolyl]methanone Formula: C24H23ClN2O3 MolecularWeight: 422.90402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)N3CCCCCC3)C4=CC5=C(C=C4)OCO5)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)N3CCCCCC3)C4=CC5=C(C=C4)OCO5)Cl

InChI

InChI=1S/C24H23ClN2O3/c1-15-19(25)8-7-17-18(24(28)27-10-4-2-3-5-11-27)13-20(26-23(15)17)16-6-9-21-22(12-16)30-14-29-21/h6-9,12-13H,2-5,10-11,14H2,1H3