(2-oxidanylidenechromen-7-yl) (2S)-2-[(4-ethoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (2-oxidanylidenechromen-7-yl) (2S)-2-[(4-ethoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (2-oxochromen-7-yl) (2S)-2-[(4-ethoxybenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4-ethoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) (2S)-2-[(4-ethoxybenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-ethoxybenzoyl)amino]-3-methyl-butyric acid (2-ketochromen-7-yl) ester Formula: C23H23NO6 MolecularWeight: 409.43182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)OC2=CC3=C(C=C2)C=CC(=O)O3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)OC2=CC3=C(C=C2)C=CC(=O)O3

InChI

InChI=1S/C23H23NO6/c1-4-28-17-9-6-16(7-10-17)22(26)24-21(14(2)3)23(27)29-18-11-5-15-8-12-20(25)30-19(15)13-18/h5-14,21H,4H2,1-3H3,(H,24,26)/t21-/m0/s1