2-[2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]ethanoylamino]pentanedioic acid

Systemtic Name: 2-[2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]ethanoylamino]pentanedioic acid Openeye Name: 2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]pentanedioic acid CAS Name: 2-[[2-[[2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-1-oxoethyl]amino]pentanedioic acid IUPAC Name: 2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]pentanedioic acid Traditional Name: 2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]glutaric acid Formula: C18H22N4O6 MolecularWeight: 390.39048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)NCC(=O)NC(CCC(=O)O)C(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)NCC(=O)NC(CCC(=O)O)C(=O)O)N

InChI

InChI=1S/C18H22N4O6/c19-12(7-10-8-20-13-4-2-1-3-11(10)13)17(26)21-9-15(23)22-14(18(27)28)5-6-16(24)25/h1-4,8,12,14,20H,5-7,9,19H2,(H,21,26)(H,22,23)(H,24,25)(H,27,28)