ethane; ethyl ethanoate; (4-nitrophenyl)diazene; [[3-(propanoylamino)phenyl]amino] ethanoate

Systemtic Name: ethane; ethyl ethanoate; (4-nitrophenyl)diazene; [[3-(propanoylamino)phenyl]amino] ethanoate Openeye Name: ethane; ethyl acetate; (4-nitrophenyl)diazene; [3-(propanoylamino)anilino] acetate CAS Name: acetic acid ethyl ester; acetic acid [3-(1-oxopropylamino)anilino] ester; ethane; (4-nitrophenyl)diazene IUPAC Name: ethane; ethyl acetate; (4-nitrophenyl)diazene; [3-(propanoylamino)anilino] acetate Traditional Name: acetic acid ethyl ester; acetic acid (3-propionamidoanilino) ester; ethane; (4-nitrophenyl)diazene Formula: C23H33N5O7 MolecularWeight: 491.53742

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Descriptors Computed from Structure

Canonical SMILES:

CC.CCC(=O)NC1=CC(=CC=C1)NOC(=O)C.CCOC(=O)C.C1=CC(=CC=C1N=N)[N+](=O)[O-]

Isomeric SMILES

CC.CCC(=O)NC1=CC(=CC=C1)NOC(=O)C.CCOC(=O)C.C1=CC(=CC=C1N=N)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O3.C6H5N3O2.C4H8O2.C2H6/c1-3-11(15)12-9-5-4-6-10(7-9)13-16-8(2)14;7-8-5-1-3-6(4-2-5)9(10)11;1-3-6-4(2)5;1-2/h4-7,13H,3H2,1-2H3,(H,12,15);1-4,7H;3H2,1-2H3;1-2H3