1-(3-propan-2-yl-4-propoxy-phenyl)sulfonylazepane

Systemtic Name: 1-(3-propan-2-yl-4-propoxy-phenyl)sulfonylazepane Openeye Name: 1-(3-isopropyl-4-propoxy-phenyl)sulfonylazepane CAS Name: 1-(3-propan-2-yl-4-propoxyphenyl)sulfonylazepane IUPAC Name: 1-(3-propan-2-yl-4-propoxyphenyl)sulfonylazepane Traditional Name: 1-(3-isopropyl-4-propoxy-phenyl)sulfonylazepane Formula: C18H29NO3S MolecularWeight: 339.49276

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(C)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(C)C

InChI

InChI=1S/C18H29NO3S/c1-4-13-22-18-10-9-16(14-17(18)15(2)3)23(20,21)19-11-7-5-6-8-12-19/h9-10,14-15H,4-8,11-13H2,1-3H3