ethyl N-[2-[ethyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]ethanoyl]carbamate

Systemtic Name: ethyl N-[2-[ethyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]ethanoyl]carbamate Openeye Name: ethyl N-[2-[ethyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]acetyl]carbamate CAS Name: N-[2-[ethyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]-1-oxoethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[ethyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]acetyl]carbamate Traditional Name: N-[2-[ethyl-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]amino]acetyl]carbamic acid ethyl ester Formula: C16H21N3O7 MolecularWeight: 367.35384

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C2C(=CC(=C1)[N+](=O)[O-])COCO2)CC(=O)NC(=O)OCC

Isomeric SMILES

CCN(CC1=C2C(=CC(=C1)[N+](=O)[O-])COCO2)CC(=O)NC(=O)OCC

InChI

InChI=1S/C16H21N3O7/c1-3-18(8-14(20)17-16(21)25-4-2)7-11-5-13(19(22)23)6-12-9-24-10-26-15(11)12/h5-6H,3-4,7-10H2,1-2H3,(H,17,20,21)