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

Systemtic Name: 2-[2,5-bis(azanyl)pentanoylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-(2,5-diaminopentanoylamino)-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[(2,5-diamino-1-oxopentyl)amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-(2,5-diaminopentanoylamino)-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-(2,5-diaminopentanoylamino)-3-(1H-indol-3-yl)propionic acid Formula: C16H22N4O3 MolecularWeight: 318.37088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)C(CCCN)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)C(CCCN)N

InChI

InChI=1S/C16H22N4O3/c17-7-3-5-12(18)15(21)20-14(16(22)23)8-10-9-19-13-6-2-1-4-11(10)13/h1-2,4,6,9,12,14,19H,3,5,7-8,17-18H2,(H,20,21)(H,22,23)