(4S)-4-azaniumyl-5-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: (4S)-4-azaniumyl-5-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]-5-oxidanylidene-pentanoate Openeye Name: (4S)-4-azaniumyl-5-[(4-methyl-2-oxo-chromen-7-yl)amino]-5-oxo-pentanoate CAS Name: (4S)-4-ammonio-5-[(4-methyl-2-oxo-1-benzopyran-7-yl)amino]-5-oxopentanoate IUPAC Name: (4S)-4-azaniumyl-5-[(4-methyl-2-oxochromen-7-yl)amino]-5-oxopentanoate Traditional Name: (4S)-4-ammonio-5-keto-5-[(2-keto-4-methyl-chromen-7-yl)amino]valerate Formula: C15H16N2O5 MolecularWeight: 304.29794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C(CCC(=O)[O-])[NH3+]

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)[C@H](CCC(=O)[O-])[NH3+]

InChI

InChI=1S/C15H16N2O5/c1-8-6-14(20)22-12-7-9(2-3-10(8)12)17-15(21)11(16)4-5-13(18)19/h2-3,6-7,11H,4-5,16H2,1H3,(H,17,21)(H,18,19)/t11-/m0/s1