[2,2-dimethyl-5,6-bis(oxidanylidene)-3,4-dihydrobenzo[h]chromen-3-yl] 3-azanylpropanoate

Systemtic Name: [2,2-dimethyl-5,6-bis(oxidanylidene)-3,4-dihydrobenzo[h]chromen-3-yl] 3-azanylpropanoate Openeye Name: (2,2-dimethyl-5,6-dioxo-3,4-dihydrobenzo[h]chromen-3-yl) 3-aminopropanoate CAS Name: 3-aminopropanoic acid (2,2-dimethyl-5,6-dioxo-3,4-dihydrobenzo[h][1]benzopyran-3-yl) ester IUPAC Name: (2,2-dimethyl-5,6-dioxo-3,4-dihydrobenzo[h]chromen-3-yl) 3-aminopropanoate Traditional Name: 3-aminopropionic acid (5,6-diketo-2,2-dimethyl-3,4-dihydrobenzo[h]chromen-3-yl) ester Formula: C18H19NO5 MolecularWeight: 329.34716

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC2=C(O1)C3=CC=CC=C3C(=O)C2=O)OC(=O)CCN)C

Isomeric SMILES

CC1(C(CC2=C(O1)C3=CC=CC=C3C(=O)C2=O)OC(=O)CCN)C

InChI

InChI=1S/C18H19NO5/c1-18(2)13(23-14(20)7-8-19)9-12-16(22)15(21)10-5-3-4-6-11(10)17(12)24-18/h3-6,13H,7-9,19H2,1-2H3