2-[2-(2-azanylpropanoylamino)ethanoylamino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[2-(2-azanylpropanoylamino)ethanoylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[[2-(2-aminopropanoylamino)acetyl]amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[2-[(2-amino-1-oxopropyl)amino]-1-oxoethyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[2-(2-aminopropanoylamino)acetyl]amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[[2-(alanylamino)acetyl]amino]-3-(1H-indol-3-yl)propionic acid Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O)N

Isomeric SMILES

CC(C(=O)NCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O)N

InChI

InChI=1S/C16H20N4O4/c1-9(17)15(22)19-8-14(21)20-13(16(23)24)6-10-7-18-12-5-3-2-4-11(10)12/h2-5,7,9,13,18H,6,8,17H2,1H3,(H,19,22)(H,20,21)(H,23,24)