methyl (2S)-2-[[4-(1H-indol-2-ylcarbonyl)piperazin-1-yl]carbonylamino]propanoate

Systemtic Name: methyl (2S)-2-[[4-(1H-indol-2-ylcarbonyl)piperazin-1-yl]carbonylamino]propanoate Openeye Name: methyl (2S)-2-[[4-(1H-indole-2-carbonyl)piperazine-1-carbonyl]amino]propanoate CAS Name: (2S)-2-[[[4-[1H-indol-2-yl(oxo)methyl]-1-piperazinyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[4-(1H-indole-2-carbonyl)piperazine-1-carbonyl]amino]propanoate Traditional Name: (2S)-2-[[4-(1H-indole-2-carbonyl)piperazine-1-carbonyl]amino]propionic acid methyl ester Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)N1CCN(CC1)C(=O)C2=CC3=CC=CC=C3N2

Isomeric SMILES

C[C@@H](C(=O)OC)NC(=O)N1CCN(CC1)C(=O)C2=CC3=CC=CC=C3N2

InChI

InChI=1S/C18H22N4O4/c1-12(17(24)26-2)19-18(25)22-9-7-21(8-10-22)16(23)15-11-13-5-3-4-6-14(13)20-15/h3-6,11-12,20H,7-10H2,1-2H3,(H,19,25)/t12-/m0/s1