(2S)-4-azanyl-2-[[(3S,6S)-6-azanyl-5-oxidanylidene-6,7-dihydro-3H-indolizin-3-yl]carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: (2S)-4-azanyl-2-[[(3S,6S)-6-azanyl-5-oxidanylidene-6,7-dihydro-3H-indolizin-3-yl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: (2S)-4-amino-2-[[(3S,6S)-6-amino-5-oxo-6,7-dihydro-3H-indolizine-3-carbonyl]amino]-4-oxo-butanoic acid CAS Name: (2S)-4-amino-2-[[[(3S,6S)-6-amino-5-oxo-6,7-dihydro-3H-indolizin-3-yl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: (2S)-4-amino-2-[[(3S,6S)-6-amino-5-oxo-6,7-dihydro-3H-indolizine-3-carbonyl]amino]-4-oxobutanoic acid Traditional Name: (2S)-4-amino-2-[[(3S,6S)-6-amino-5-keto-6,7-dihydro-3H-indolizine-3-carbonyl]amino]-4-keto-butyric acid Formula: C13H16N4O5 MolecularWeight: 308.28994

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C2C=CC(N2C(=O)C1N)C(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

C1C=C2C=C[C@H](N2C(=O)[C@H]1N)C(=O)N[C@@H](CC(=O)N)C(=O)O

InChI

InChI=1S/C13H16N4O5/c14-7-3-1-6-2-4-9(17(6)12(7)20)11(19)16-8(13(21)22)5-10(15)18/h1-2,4,7-9H,3,5,14H2,(H2,15,18)(H,16,19)(H,21,22)/t7-,8-,9-/m0/s1