N-[(4-butoxy-3-methoxy-phenyl)methyl]-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: N-(4-butoxy-3-methoxy-benzyl)-3-(3-keto-1,4-benzoxazin-4-yl)propionamide Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=O)CCN2C(=O)COC3=CC=CC=C32)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=O)CCN2C(=O)COC3=CC=CC=C32)OC

InChI

InChI=1S/C23H28N2O5/c1-3-4-13-29-20-10-9-17(14-21(20)28-2)15-24-22(26)11-12-25-18-7-5-6-8-19(18)30-16-23(25)27/h5-10,14H,3-4,11-13,15-16H2,1-2H3,(H,24,26)