N-[[1-[3-(2-methoxy-4-prop-2-enyl-phenoxy)propyl]benzimidazol-2-yl]methyl]pyridine-3-carboxamide

Systemtic Name: N-[[1-[3-(2-methoxy-4-prop-2-enyl-phenoxy)propyl]benzimidazol-2-yl]methyl]pyridine-3-carboxamide Openeye Name: N-[[1-[3-(4-allyl-2-methoxy-phenoxy)propyl]benzimidazol-2-yl]methyl]pyridine-3-carboxamide CAS Name: N-[[1-[3-(2-methoxy-4-prop-2-enylphenoxy)propyl]-2-benzimidazolyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-[[1-[3-(2-methoxy-4-prop-2-enylphenoxy)propyl]benzimidazol-2-yl]methyl]pyridine-3-carboxamide Traditional Name: N-[[1-[3-(4-allyl-2-methoxy-phenoxy)propyl]benzimidazol-2-yl]methyl]nicotinamide Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCCCN2C3=CC=CC=C3N=C2CNC(=O)C4=CN=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCCCN2C3=CC=CC=C3N=C2CNC(=O)C4=CN=CC=C4

InChI

InChI=1S/C27H28N4O3/c1-3-8-20-12-13-24(25(17-20)33-2)34-16-7-15-31-23-11-5-4-10-22(23)30-26(31)19-29-27(32)21-9-6-14-28-18-21/h3-6,9-14,17-18H,1,7-8,15-16,19H2,2H3,(H,29,32)