N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-3,4-dihydro-2H-chromene-3-carboxamide

Systemtic Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]chromane-3-carboxamide CAS Name: N-[[6-(1-azepanyl)-3-pyridinyl]methyl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]chroman-3-carboxamide Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)C3CC4=CC=CC=C4OC3

Isomeric SMILES

C1CCCN(CC1)C2=NC=C(C=C2)CNC(=O)C3CC4=CC=CC=C4OC3

InChI

InChI=1S/C22H27N3O2/c26-22(19-13-18-7-3-4-8-20(18)27-16-19)24-15-17-9-10-21(23-14-17)25-11-5-1-2-6-12-25/h3-4,7-10,14,19H,1-2,5-6,11-13,15-16H2,(H,24,26)