4-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-3-ethoxy-benzaldehyde

Systemtic Name: 4-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-3-ethoxy-benzaldehyde Openeye Name: 4-[2-(azepan-1-yl)-2-oxo-ethoxy]-3-ethoxy-benzaldehyde CAS Name: 4-[2-(1-azepanyl)-2-oxoethoxy]-3-ethoxybenzaldehyde IUPAC Name: 4-[2-(azepan-1-yl)-2-oxoethoxy]-3-ethoxybenzaldehyde Traditional Name: 4-[2-(azepan-1-yl)-2-keto-ethoxy]-3-ethoxy-benzaldehyde Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=O)OCC(=O)N2CCCCCC2

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=O)OCC(=O)N2CCCCCC2

InChI

InChI=1S/C17H23NO4/c1-2-21-16-11-14(12-19)7-8-15(16)22-13-17(20)18-9-5-3-4-6-10-18/h7-8,11-12H,2-6,9-10,13H2,1H3