prop-2-enyl 4-[3-ethoxy-4-(3-methylbutoxy)phenyl]-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: prop-2-enyl 4-[3-ethoxy-4-(3-methylbutoxy)phenyl]-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: allyl 4-(3-ethoxy-4-isopentyloxy-phenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 4-[3-ethoxy-4-(3-methylbutoxy)phenyl]-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-[3-ethoxy-4-(3-methylbutoxy)phenyl]-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 4-(3-ethoxy-4-isoamoxy-phenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid allyl ester Formula: C28H33N3O4 MolecularWeight: 475.57932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(NC3=NC4=CC=CC=C4N23)C)C(=O)OCC=C)OCCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(NC3=NC4=CC=CC=C4N23)C)C(=O)OCC=C)OCCC(C)C

InChI

InChI=1S/C28H33N3O4/c1-6-15-35-27(32)25-19(5)29-28-30-21-10-8-9-11-22(21)31(28)26(25)20-12-13-23(24(17-20)33-7-2)34-16-14-18(3)4/h6,8-13,17-18,26H,1,7,14-16H2,2-5H3,(H,29,30)