(2R)-2-[(5-azanylpyridin-1-ium-2-yl)amino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: (2R)-2-[(5-azanylpyridin-1-ium-2-yl)amino]-3-(1H-indol-3-yl)propanoate Openeye Name: (2R)-2-[(5-aminopyridin-1-ium-2-yl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-[(5-amino-2-pyridin-1-iumyl)amino]-3-(1H-indol-3-yl)propanoate IUPAC Name: (2R)-2-[(5-aminopyridin-1-ium-2-yl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-2-[(5-aminopyridin-1-ium-2-yl)amino]-3-(1H-indol-3-yl)propionate Formula: C16H16N4O2 MolecularWeight: 296.32384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)[O-])NC3=[NH+]C=C(C=C3)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@H](C(=O)[O-])NC3=[NH+]C=C(C=C3)N

InChI

InChI=1S/C16H16N4O2/c17-11-5-6-15(19-9-11)20-14(16(21)22)7-10-8-18-13-4-2-1-3-12(10)13/h1-6,8-9,14,18H,7,17H2,(H,19,20)(H,21,22)/t14-/m1/s1