[2-(4-ethoxy-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propyl] 4-acetamidobenzoate

Systemtic Name: [2-(4-ethoxy-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propyl] 4-acetamidobenzoate Openeye Name: [2-(4-ethoxy-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propyl] 4-acetamidobenzoate CAS Name: 4-acetamidobenzoic acid [2-(4-ethoxy-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl)-2-methylpropyl] ester IUPAC Name: [2-(4-ethoxy-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl)-2-methylpropyl] 4-acetamidobenzoate Traditional Name: 4-acetamidobenzoic acid [2-(4-ethoxy-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propyl] ester Formula: C25H29N3O4 MolecularWeight: 435.51546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC(NC2=C1C=C(C=C2)[N+]#[C-])C(C)(C)COC(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCOC1CC(NC2=C1C=C(C=C2)[N+]#[C-])C(C)(C)COC(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C25H29N3O4/c1-6-31-22-14-23(28-21-12-11-19(26-5)13-20(21)22)25(3,4)15-32-24(30)17-7-9-18(10-8-17)27-16(2)29/h7-13,22-23,28H,6,14-15H2,1-4H3,(H,27,29)