tert-butyl 3-(1H-indol-3-yl)-2-[(5-methyl-4-oxidanylidene-3,1-benzoxazin-2-yl)amino]propanoate

Systemtic Name: tert-butyl 3-(1H-indol-3-yl)-2-[(5-methyl-4-oxidanylidene-3,1-benzoxazin-2-yl)amino]propanoate Openeye Name: tert-butyl 3-(1H-indol-3-yl)-2-[(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]propanoate CAS Name: 3-(1H-indol-3-yl)-2-[(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(1H-indol-3-yl)-2-[(5-methyl-4-oxo-3,1-benzoxazin-2-yl)amino]propanoate Traditional Name: 3-(1H-indol-3-yl)-2-[(4-keto-5-methyl-3,1-benzoxazin-2-yl)amino]propionic acid tert-butyl ester Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(OC2=O)NC(CC3=CNC4=CC=CC=C43)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(OC2=O)NC(CC3=CNC4=CC=CC=C43)C(=O)OC(C)(C)C

InChI

InChI=1S/C24H25N3O4/c1-14-8-7-11-18-20(14)22(29)30-23(26-18)27-19(21(28)31-24(2,3)4)12-15-13-25-17-10-6-5-9-16(15)17/h5-11,13,19,25H,12H2,1-4H3,(H,26,27)