6-[2-chloranyl-4-[(3-methylbutylamino)methyl]phenoxy]pyridine-3-carboxamide

Systemtic Name: 6-[2-chloranyl-4-[(3-methylbutylamino)methyl]phenoxy]pyridine-3-carboxamide Openeye Name: 6-[2-chloro-4-[(isopentylamino)methyl]phenoxy]pyridine-3-carboxamide CAS Name: 6-[2-chloro-4-[(3-methylbutylamino)methyl]phenoxy]-3-pyridinecarboxamide IUPAC Name: 6-[2-chloro-4-[(3-methylbutylamino)methyl]phenoxy]pyridine-3-carboxamide Traditional Name: 6-[2-chloro-4-[(isoamylamino)methyl]phenoxy]nicotinamide Formula: C18H22ClN3O2 MolecularWeight: 347.83918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNCC1=CC(=C(C=C1)OC2=NC=C(C=C2)C(=O)N)Cl

Isomeric SMILES

CC(C)CCNCC1=CC(=C(C=C1)OC2=NC=C(C=C2)C(=O)N)Cl

InChI

InChI=1S/C18H22ClN3O2/c1-12(2)7-8-21-10-13-3-5-16(15(19)9-13)24-17-6-4-14(11-22-17)18(20)23/h3-6,9,11-12,21H,7-8,10H2,1-2H3,(H2,20,23)