tert-butyl N-(3-azanylpropanoyl)-N-[3-[1-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)propyl]phenyl]carbamate

Systemtic Name: tert-butyl N-(3-azanylpropanoyl)-N-[3-[1-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)propyl]phenyl]carbamate Openeye Name: tert-butyl N-(3-aminopropanoyl)-N-[3-[1-(2-hydroxy-4-oxo-chromen-3-yl)propyl]phenyl]carbamate CAS Name: N-(3-amino-1-oxopropyl)-N-[3-[1-(2-hydroxy-4-oxo-1-benzopyran-3-yl)propyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-aminopropanoyl)-N-[3-[1-(2-hydroxy-4-oxochromen-3-yl)propyl]phenyl]carbamate Traditional Name: N-(3-aminopropanoyl)-N-[3-[1-(2-hydroxy-4-keto-chromen-3-yl)propyl]phenyl]carbamic acid tert-butyl ester Formula: C26H30N2O6 MolecularWeight: 466.5262

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)N(C(=O)CCN)C(=O)OC(C)(C)C)C2=C(OC3=CC=CC=C3C2=O)O

Isomeric SMILES

CCC(C1=CC(=CC=C1)N(C(=O)CCN)C(=O)OC(C)(C)C)C2=C(OC3=CC=CC=C3C2=O)O

InChI

InChI=1S/C26H30N2O6/c1-5-18(22-23(30)19-11-6-7-12-20(19)33-24(22)31)16-9-8-10-17(15-16)28(21(29)13-14-27)25(32)34-26(2,3)4/h6-12,15,18,31H,5,13-14,27H2,1-4H3