N-[(5aR,9aS)-5,5a,6,7,8,9-hexahydro-4H-benzo[e][1]benzothiol-9a-yl]carbamate

Systemtic Name: N-[(5aR,9aS)-5,5a,6,7,8,9-hexahydro-4H-benzo[e][1]benzothiol-9a-yl]carbamate Openeye Name: N-[(5aR,9aS)-5,5a,6,7,8,9-hexahydro-4H-benzo[e]benzothiophen-9a-yl]carbamate CAS Name: N-[(5aR,9aS)-5,5a,6,7,8,9-hexahydro-4H-benzo[e][1]benzothiol-9a-yl]carbamate IUPAC Name: N-[(5aR,9aS)-5,5a,6,7,8,9-hexahydro-4H-benzo[e][1]benzothiol-9a-yl]carbamate Traditional Name: N-[(5aR,9aS)-5,5a,6,7,8,9-hexahydro-4H-benzo[e]benzothiophen-9a-yl]carbamate Formula: C13H16NO2S- MolecularWeight: 250.33664

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C(C1)CCC3=C2C=CS3)NC(=O)[O-]

Isomeric SMILES

C1CC[C@@]2([C@H](C1)CCC3=C2C=CS3)NC(=O)[O-]

InChI

InChI=1S/C13H17NO2S/c15-12(16)14-13-7-2-1-3-9(13)4-5-11-10(13)6-8-17-11/h6,8-9,14H,1-5,7H2,(H,15,16)/p-1/t9-,13+/m1/s1