(2S)-2-[(4-carbamimidoyl-6-oxidanyl-cyclohexa-1,2,3,5-tetraen-1-yl)methylamino]propanoic acid

Systemtic Name: (2S)-2-[(4-carbamimidoyl-6-oxidanyl-cyclohexa-1,2,3,5-tetraen-1-yl)methylamino]propanoic acid Openeye Name: (2S)-2-[(4-carbamimidoyl-6-hydroxy-cyclohexa-1,2,3,5-tetraen-1-yl)methylamino]propanoic acid CAS Name: (2S)-2-[(4-carbamimidoyl-6-hydroxy-1-cyclohexa-1,2,3,5-tetraenyl)methylamino]propanoic acid IUPAC Name: (2S)-2-[(4-carbamimidoyl-6-hydroxycyclohexa-1,2,3,5-tetraen-1-yl)methylamino]propanoic acid Traditional Name: (2S)-2-[(4-amidino-6-hydroxy-cyclohexa-1,2,3,5-tetraen-1-yl)methylamino]propionic acid Formula: C11H13N3O3 MolecularWeight: 235.23922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NCC1=C=C=C(C=C1O)C(=N)N

Isomeric SMILES

C[C@@H](C(=O)O)NCC1=C=C=C(C=C1O)C(=N)N

InChI

InChI=1S/C11H13N3O3/c1-6(11(16)17)14-5-8-3-2-7(10(12)13)4-9(8)15/h4,6,14-15H,5H2,1H3,(H3,12,13)(H,16,17)/t6-/m0/s1