(2S)-2-(anthracen-9-ylcarbonylamino)-6-azanyl-hexanoic acid

Systemtic Name: (2S)-2-(anthracen-9-ylcarbonylamino)-6-azanyl-hexanoic acid Openeye Name: (2S)-6-amino-2-(anthracene-9-carbonylamino)hexanoic acid CAS Name: (2S)-6-amino-2-[[9-anthracenyl(oxo)methyl]amino]hexanoic acid IUPAC Name: (2S)-6-amino-2-(anthracene-9-carbonylamino)hexanoic acid Traditional Name: (2S)-6-amino-2-(anthracene-9-carbonylamino)hexanoic acid Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C(=O)NC(CCCCN)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C(=O)N[C@@H](CCCCN)C(=O)O

InChI

InChI=1S/C21H22N2O3/c22-12-6-5-11-18(21(25)26)23-20(24)19-16-9-3-1-7-14(16)13-15-8-2-4-10-17(15)19/h1-4,7-10,13,18H,5-6,11-12,22H2,(H,23,24)(H,25,26)/t18-/m0/s1