N-[1,1-bis(oxidanylidene)thian-4-yl]-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine

Systemtic Name: N-[1,1-bis(oxidanylidene)thian-4-yl]-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Openeye Name: N-(1,1-dioxothian-4-yl)-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine CAS Name: N-(1,1-dioxo-4-thianyl)-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine IUPAC Name: N-(1,1-dioxothian-4-yl)-9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine Traditional Name: (1,1-diketothian-4-yl)-(9-methyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)amine Formula: C16H23NO3S MolecularWeight: 309.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OCCCC2NC3CCS(=O)(=O)CC3

Isomeric SMILES

CC1=CC=CC2=C1OCCCC2NC3CCS(=O)(=O)CC3

InChI

InChI=1S/C16H23NO3S/c1-12-4-2-5-14-15(6-3-9-20-16(12)14)17-13-7-10-21(18,19)11-8-13/h2,4-5,13,15,17H,3,6-11H2,1H3