2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]-3-(4H-imidazol-4-yl)propanoic acid

Systemtic Name: 2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]-3-(4H-imidazol-4-yl)propanoic acid Openeye Name: 2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-(4H-imidazol-4-yl)propanoic acid CAS Name: 2-[[2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-3-(4H-imidazol-4-yl)propanoic acid IUPAC Name: 2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-(4H-imidazol-4-yl)propanoic acid Traditional Name: 2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-(4H-imidazol-4-yl)propionic acid Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)NC(CC3C=NC=N3)C(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)NC(CC3C=NC=N3)C(=O)O)N

InChI

InChI=1S/C17H19N5O3/c18-13(5-10-7-20-14-4-2-1-3-12(10)14)16(23)22-15(17(24)25)6-11-8-19-9-21-11/h1-4,7-9,11,13,15,20H,5-6,18H2,(H,22,23)(H,24,25)