4-(azepan-1-yl)-1-(3-methoxypropyl)-6-methyl-2-oxidanylidene-pyridine-3-carbaldehyde

Systemtic Name: 4-(azepan-1-yl)-1-(3-methoxypropyl)-6-methyl-2-oxidanylidene-pyridine-3-carbaldehyde Openeye Name: 4-(azepan-1-yl)-1-(3-methoxypropyl)-6-methyl-2-oxo-pyridine-3-carbaldehyde CAS Name: 4-(1-azepanyl)-1-(3-methoxypropyl)-6-methyl-2-oxo-3-pyridinecarboxaldehyde IUPAC Name: 4-(azepan-1-yl)-1-(3-methoxypropyl)-6-methyl-2-oxopyridine-3-carbaldehyde Traditional Name: 4-(azepan-1-yl)-2-keto-1-(3-methoxypropyl)-6-methyl-nicotinaldehyde Formula: C17H26N2O3 MolecularWeight: 306.39994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1CCCOC)C=O)N2CCCCCC2

Isomeric SMILES

CC1=CC(=C(C(=O)N1CCCOC)C=O)N2CCCCCC2

InChI

InChI=1S/C17H26N2O3/c1-14-12-16(18-8-5-3-4-6-9-18)15(13-20)17(21)19(14)10-7-11-22-2/h12-13H,3-11H2,1-2H3