methyl (2S)-2-acetamido-3-(1-nitrosoindol-3-yl)propanoate

Systemtic Name: methyl (2S)-2-acetamido-3-(1-nitrosoindol-3-yl)propanoate Openeye Name: methyl (2S)-2-acetamido-3-(1-nitrosoindol-3-yl)propanoate CAS Name: (2S)-2-acetamido-3-(1-nitroso-3-indolyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-acetamido-3-(1-nitrosoindol-3-yl)propanoate Traditional Name: (2S)-2-acetamido-3-(1-nitrosoindol-3-yl)propionic acid methyl ester Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CN(C2=CC=CC=C21)N=O)C(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](CC1=CN(C2=CC=CC=C21)N=O)C(=O)OC

InChI

InChI=1S/C14H15N3O4/c1-9(18)15-12(14(19)21-2)7-10-8-17(16-20)13-6-4-3-5-11(10)13/h3-6,8,12H,7H2,1-2H3,(H,15,18)/t12-/m0/s1