2-[3-azanyl-2-(1,3-benzodioxol-5-yl)butyl]-N-phenyl-pyridine-4-carboxamide

Systemtic Name: 2-[3-azanyl-2-(1,3-benzodioxol-5-yl)butyl]-N-phenyl-pyridine-4-carboxamide Openeye Name: 2-[3-amino-2-(1,3-benzodioxol-5-yl)butyl]-N-phenyl-pyridine-4-carboxamide CAS Name: 2-[3-amino-2-(1,3-benzodioxol-5-yl)butyl]-N-phenyl-4-pyridinecarboxamide IUPAC Name: 2-[3-amino-2-(1,3-benzodioxol-5-yl)butyl]-N-phenylpyridine-4-carboxamide Traditional Name: 2-[3-amino-2-(1,3-benzodioxol-5-yl)butyl]-N-phenyl-isonicotinamide Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=NC=CC(=C1)C(=O)NC2=CC=CC=C2)C3=CC4=C(C=C3)OCO4)N

Isomeric SMILES

CC(C(CC1=NC=CC(=C1)C(=O)NC2=CC=CC=C2)C3=CC4=C(C=C3)OCO4)N

InChI

InChI=1S/C23H23N3O3/c1-15(24)20(16-7-8-21-22(12-16)29-14-28-21)13-19-11-17(9-10-25-19)23(27)26-18-5-3-2-4-6-18/h2-12,15,20H,13-14,24H2,1H3,(H,26,27)