2-(3,4,5a,6-tetrahydro-2H-1,5-benzodioxepin-6-ylmethylamino)ethyl carbamate

Systemtic Name: 2-(3,4,5a,6-tetrahydro-2H-1,5-benzodioxepin-6-ylmethylamino)ethyl carbamate Openeye Name: 2-(3,4,5a,6-tetrahydro-2H-1,5-benzodioxepin-6-ylmethylamino)ethyl carbamate CAS Name: carbamic acid 2-(3,4,5a,6-tetrahydro-2H-1,5-benzodioxepin-6-ylmethylamino)ethyl ester IUPAC Name: 2-(3,4,5a,6-tetrahydro-2H-1,5-benzodioxepin-6-ylmethylamino)ethyl carbamate Traditional Name: carbamic acid 2-(3,4,5a,6-tetrahydro-2H-1,5-benzodioxepin-6-ylmethylamino)ethyl ester Formula: C13H20N2O4 MolecularWeight: 268.3089

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2C(C=CC=C2OC1)CNCCOC(=O)N

Isomeric SMILES

C1COC2C(C=CC=C2OC1)CNCCOC(=O)N

InChI

InChI=1S/C13H20N2O4/c14-13(16)19-8-5-15-9-10-3-1-4-11-12(10)18-7-2-6-17-11/h1,3-4,10,12,15H,2,5-9H2,(H2,14,16)