ethyl 2-[2-(imidazol-1-ylmethyl)-6-methyl-4-(3-nitrophenyl)-4H-pyridin-1-yl]ethanoate

Systemtic Name: ethyl 2-[2-(imidazol-1-ylmethyl)-6-methyl-4-(3-nitrophenyl)-4H-pyridin-1-yl]ethanoate Openeye Name: ethyl 2-[2-(imidazol-1-ylmethyl)-6-methyl-4-(3-nitrophenyl)-4H-pyridin-1-yl]acetate CAS Name: 2-[2-(1-imidazolylmethyl)-6-methyl-4-(3-nitrophenyl)-4H-pyridin-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(imidazol-1-ylmethyl)-6-methyl-4-(3-nitrophenyl)-4H-pyridin-1-yl]acetate Traditional Name: 2-[2-(imidazol-1-ylmethyl)-6-methyl-4-(3-nitrophenyl)-4H-pyridin-1-yl]acetic acid ethyl ester Formula: C20H22N4O4 MolecularWeight: 382.41308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=CC(C=C1CN2C=CN=C2)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)CN1C(=CC(C=C1CN2C=CN=C2)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H22N4O4/c1-3-28-20(25)13-23-15(2)9-17(11-19(23)12-22-8-7-21-14-22)16-5-4-6-18(10-16)24(26)27/h4-11,14,17H,3,12-13H2,1-2H3