1-(3-isocyanatopiperidin-1-yl)sulfonylazepane

Systemtic Name: 1-(3-isocyanatopiperidin-1-yl)sulfonylazepane Openeye Name: 1-[(3-isocyanato-1-piperidyl)sulfonyl]azepane CAS Name: 1-[(3-isocyanato-1-piperidinyl)sulfonyl]azepane IUPAC Name: 1-(3-isocyanatopiperidin-1-yl)sulfonylazepane Traditional Name: 1-(3-isocyanatopiperidino)sulfonylazepane Formula: C12H21N3O3S MolecularWeight: 287.37844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCCC(C2)N=C=O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCCC(C2)N=C=O

InChI

InChI=1S/C12H21N3O3S/c16-11-13-12-6-5-9-15(10-12)19(17,18)14-7-3-1-2-4-8-14/h12H,1-10H2