(1-cyanoindolizin-2-yl)methyl 2-[(4-butoxyphenyl)carbonylamino]ethanoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 2-[(4-butoxyphenyl)carbonylamino]ethanoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 2-[(4-butoxybenzoyl)amino]acetate CAS Name: 2-[[(4-butoxyphenyl)-oxomethyl]amino]acetic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 2-[(4-butoxybenzoyl)amino]acetate Traditional Name: 2-[(4-butoxybenzoyl)amino]acetic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CN3C=CC=CC3=C2C#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CN3C=CC=CC3=C2C#N

InChI

InChI=1S/C23H23N3O4/c1-2-3-12-29-19-9-7-17(8-10-19)23(28)25-14-22(27)30-16-18-15-26-11-5-4-6-21(26)20(18)13-24/h4-11,15H,2-3,12,14,16H2,1H3,(H,25,28)