ethyl 2-[4-[(2-chloranyl-4-nitro-quinolin-3-yl)-methyl-amino]phenoxy]propanoate

Systemtic Name: ethyl 2-[4-[(2-chloranyl-4-nitro-quinolin-3-yl)-methyl-amino]phenoxy]propanoate Openeye Name: ethyl 2-[4-[(2-chloro-4-nitro-3-quinolyl)-methyl-amino]phenoxy]propanoate CAS Name: 2-[4-[(2-chloro-4-nitro-3-quinolinyl)-methylamino]phenoxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[4-[(2-chloro-4-nitroquinolin-3-yl)-methylamino]phenoxy]propanoate Traditional Name: 2-[4-[(2-chloro-4-nitro-3-quinolyl)-methyl-amino]phenoxy]propionic acid ethyl ester Formula: C21H20ClN3O5 MolecularWeight: 429.8536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC=C(C=C1)N(C)C2=C(C3=CC=CC=C3N=C2Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(C)OC1=CC=C(C=C1)N(C)C2=C(C3=CC=CC=C3N=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H20ClN3O5/c1-4-29-21(26)13(2)30-15-11-9-14(10-12-15)24(3)19-18(25(27)28)16-7-5-6-8-17(16)23-20(19)22/h5-13H,4H2,1-3H3