4-[(6-indol-1-ylpyrazin-2-yl)amino]butanoic acid

Systemtic Name: 4-[(6-indol-1-ylpyrazin-2-yl)amino]butanoic acid Openeye Name: 4-[(6-indol-1-ylpyrazin-2-yl)amino]butanoic acid CAS Name: 4-[[6-(1-indolyl)-2-pyrazinyl]amino]butanoic acid IUPAC Name: 4-[(6-indol-1-ylpyrazin-2-yl)amino]butanoic acid Traditional Name: 4-[(6-indol-1-ylpyrazin-2-yl)amino]butyric acid Formula: C16H16N4O2 MolecularWeight: 296.32384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN2C3=CN=CC(=N3)NCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CN2C3=CN=CC(=N3)NCCCC(=O)O

InChI

InChI=1S/C16H16N4O2/c21-16(22)6-3-8-18-14-10-17-11-15(19-14)20-9-7-12-4-1-2-5-13(12)20/h1-2,4-5,7,9-11H,3,6,8H2,(H,18,19)(H,21,22)