quinolin-8-ylmethyl 2-[(3-methyl-4-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: quinolin-8-ylmethyl 2-[(3-methyl-4-nitro-phenyl)carbonylamino]ethanoate Openeye Name: 8-quinolylmethyl 2-[(3-methyl-4-nitro-benzoyl)amino]acetate CAS Name: 2-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]acetic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 2-[(3-methyl-4-nitrobenzoyl)amino]acetate Traditional Name: 2-[(3-methyl-4-nitro-benzoyl)amino]acetic acid 8-quinolylmethyl ester Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC(=O)OCC2=CC=CC3=C2N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC(=O)OCC2=CC=CC3=C2N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O5/c1-13-10-15(7-8-17(13)23(26)27)20(25)22-11-18(24)28-12-16-5-2-4-14-6-3-9-21-19(14)16/h2-10H,11-12H2,1H3,(H,22,25)