tert-butyl (2S)-2-[2-(7-azanyl-2-oxidanylidene-chromen-4-yl)ethanoylamino]-3-phenyl-propanoate

Systemtic Name: tert-butyl (2S)-2-[2-(7-azanyl-2-oxidanylidene-chromen-4-yl)ethanoylamino]-3-phenyl-propanoate Openeye Name: tert-butyl (2S)-2-[[2-(7-amino-2-oxo-chromen-4-yl)acetyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-(7-amino-2-oxo-1-benzopyran-4-yl)-1-oxoethyl]amino]-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[2-(7-amino-2-oxochromen-4-yl)acetyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-(7-amino-2-keto-chromen-4-yl)acetyl]amino]-3-phenyl-propionic acid tert-butyl ester Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=CC=C1)NC(=O)CC2=CC(=O)OC3=C2C=CC(=C3)N

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CC2=CC(=O)OC3=C2C=CC(=C3)N

InChI

InChI=1S/C24H26N2O5/c1-24(2,3)31-23(29)19(11-15-7-5-4-6-8-15)26-21(27)12-16-13-22(28)30-20-14-17(25)9-10-18(16)20/h4-10,13-14,19H,11-12,25H2,1-3H3,(H,26,27)/t19-/m0/s1