N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide

Systemtic Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide Openeye Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide IUPAC Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-3-(3-keto-1,4-benzoxazin-4-yl)propionamide Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)CCN2C(=O)COC3=CC=CC=C32)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](C)NC(=O)CCN2C(=O)COC3=CC=CC=C32)OCC

InChI

InChI=1S/C23H28N2O5/c1-4-28-20-11-10-17(14-21(20)29-5-2)16(3)24-22(26)12-13-25-18-8-6-7-9-19(18)30-15-23(25)27/h6-11,14,16H,4-5,12-13,15H2,1-3H3,(H,24,26)/t16-/m0/s1