N-[(2S)-1-(ethoxymethoxy)-5-oxidanylidene-5-[oxidanyl(prop-2-ynoxymethyl)amino]pentan-2-yl]-4-nitro-benzamide

Systemtic Name: N-[(2S)-1-(ethoxymethoxy)-5-oxidanylidene-5-[oxidanyl(prop-2-ynoxymethyl)amino]pentan-2-yl]-4-nitro-benzamide Openeye Name: N-[(1S)-1-(ethoxymethoxymethyl)-4-[hydroxy(prop-2-ynoxymethyl)amino]-4-oxo-butyl]-4-nitro-benzamide CAS Name: N-[(2S)-1-(ethoxymethoxy)-5-[hydroxy(prop-2-ynoxymethyl)amino]-5-oxopentan-2-yl]-4-nitrobenzamide IUPAC Name: N-[(2S)-1-(ethoxymethoxy)-5-[hydroxy(prop-2-ynoxymethyl)amino]-5-oxopentan-2-yl]-4-nitrobenzamide Traditional Name: N-[(1S)-1-(ethoxymethoxymethyl)-4-[hydroxy(propargyloxymethyl)amino]-4-keto-butyl]-4-nitro-benzamide Formula: C19H25N3O8 MolecularWeight: 423.4171

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Descriptors Computed from Structure

Canonical SMILES:

CCOCOCC(CCC(=O)N(COCC#C)O)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCOCOC[C@H](CCC(=O)N(COCC#C)O)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C19H25N3O8/c1-3-11-29-13-21(25)18(23)10-7-16(12-30-14-28-4-2)20-19(24)15-5-8-17(9-6-15)22(26)27/h1,5-6,8-9,16,25H,4,7,10-14H2,2H3,(H,20,24)/t16-/m0/s1