ethyl N-[6-azanyl-4-[[1-(1,3-benzodioxol-5-yl)-1-oxidanyl-propan-2-yl]amino]-5-nitro-pyridin-2-yl]carbamate

Systemtic Name: ethyl N-[6-azanyl-4-[[1-(1,3-benzodioxol-5-yl)-1-oxidanyl-propan-2-yl]amino]-5-nitro-pyridin-2-yl]carbamate Openeye Name: ethyl N-[6-amino-4-[[2-(1,3-benzodioxol-5-yl)-2-hydroxy-1-methyl-ethyl]amino]-5-nitro-2-pyridyl]carbamate CAS Name: N-[6-amino-4-[[1-(1,3-benzodioxol-5-yl)-1-hydroxypropan-2-yl]amino]-5-nitro-2-pyridinyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[6-amino-4-[[1-(1,3-benzodioxol-5-yl)-1-hydroxypropan-2-yl]amino]-5-nitropyridin-2-yl]carbamate Traditional Name: N-[6-amino-4-[[2-(1,3-benzodioxol-5-yl)-2-hydroxy-1-methyl-ethyl]amino]-5-nitro-2-pyridyl]carbamic acid ethyl ester Formula: C18H21N5O7 MolecularWeight: 419.38864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC(=C(C(=C1)NC(C)C(C2=CC3=C(C=C2)OCO3)O)[N+](=O)[O-])N

Isomeric SMILES

CCOC(=O)NC1=NC(=C(C(=C1)NC(C)C(C2=CC3=C(C=C2)OCO3)O)[N+](=O)[O-])N

InChI

InChI=1S/C18H21N5O7/c1-3-28-18(25)22-14-7-11(15(23(26)27)17(19)21-14)20-9(2)16(24)10-4-5-12-13(6-10)30-8-29-12/h4-7,9,16,24H,3,8H2,1-2H3,(H4,19,20,21,22,25)