ethyl N-[6-azanyl-4-[[(Z)-2-(4-methylphenyl)-3-oxidanyl-prop-2-enyl]amino]-5-nitro-pyridin-2-yl]carbamate

Systemtic Name: ethyl N-[6-azanyl-4-[[(Z)-2-(4-methylphenyl)-3-oxidanyl-prop-2-enyl]amino]-5-nitro-pyridin-2-yl]carbamate Openeye Name: ethyl N-[6-amino-4-[[(Z)-3-hydroxy-2-(p-tolyl)allyl]amino]-5-nitro-2-pyridyl]carbamate CAS Name: N-[6-amino-4-[[(Z)-3-hydroxy-2-(4-methylphenyl)prop-2-enyl]amino]-5-nitro-2-pyridinyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[6-amino-4-[[(Z)-3-hydroxy-2-(4-methylphenyl)prop-2-enyl]amino]-5-nitropyridin-2-yl]carbamate Traditional Name: N-[6-amino-4-[[(Z)-3-hydroxy-2-(p-tolyl)allyl]amino]-5-nitro-2-pyridyl]carbamic acid ethyl ester Formula: C18H21N5O5 MolecularWeight: 387.38984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC(=C(C(=C1)NCC(=CO)C2=CC=C(C=C2)C)[N+](=O)[O-])N

Isomeric SMILES

CCOC(=O)NC1=NC(=C(C(=C1)NC/C(=C\O)/C2=CC=C(C=C2)C)[N+](=O)[O-])N

InChI

InChI=1S/C18H21N5O5/c1-3-28-18(25)22-15-8-14(16(23(26)27)17(19)21-15)20-9-13(10-24)12-6-4-11(2)5-7-12/h4-8,10,24H,3,9H2,1-2H3,(H4,19,20,21,22,25)/b13-10+