2-azanyl-3-[1-[2,5-bis(azanyl)-5-oxidanylidene-pentanoyl]indol-3-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[1-[2,5-bis(azanyl)-5-oxidanylidene-pentanoyl]indol-3-yl]propanoic acid Openeye Name: 2-amino-3-[1-(2,5-diamino-5-oxo-pentanoyl)indol-3-yl]propanoic acid CAS Name: 2-amino-3-[1-(2,5-diamino-1,5-dioxopentyl)-3-indolyl]propanoic acid IUPAC Name: 2-amino-3-[1-(2,5-diamino-5-oxopentanoyl)indol-3-yl]propanoic acid Traditional Name: 2-amino-3-[1-(2,5-diamino-5-keto-pentanoyl)indol-3-yl]propionic acid Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2C(=O)C(CCC(=O)N)N)CC(C(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2C(=O)C(CCC(=O)N)N)CC(C(=O)O)N

InChI

InChI=1S/C16H20N4O4/c17-11(5-6-14(19)21)15(22)20-8-9(7-12(18)16(23)24)10-3-1-2-4-13(10)20/h1-4,8,11-12H,5-7,17-18H2,(H2,19,21)(H,23,24)