azepan-1-yl-[1-(4-ethoxy-3-methyl-phenyl)sulfonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(4-ethoxy-3-methyl-phenyl)sulfonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(4-ethoxy-3-methyl-phenyl)sulfonyl-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-(4-ethoxy-3-methylphenyl)sulfonyl-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(4-ethoxy-3-methylphenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(4-ethoxy-3-methyl-phenyl)sulfonyl-4-piperidyl]methanone Formula: C21H32N2O4S MolecularWeight: 408.55478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCCCC3)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCCCC3)C

InChI

InChI=1S/C21H32N2O4S/c1-3-27-20-9-8-19(16-17(20)2)28(25,26)23-14-10-18(11-15-23)21(24)22-12-6-4-5-7-13-22/h8-9,16,18H,3-7,10-15H2,1-2H3