3-acetamido-4-[bis(azanyl)methylideneamino]-2-(propylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: 3-acetamido-4-[bis(azanyl)methylideneamino]-2-(propylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: 3-acetamido-4-guanidino-2-(propylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: 3-acetamido-4-(diaminomethylideneamino)-2-[oxo(propylamino)methyl]-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: 3-acetamido-4-(diaminomethylideneamino)-2-(propylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: 3-acetamido-4-guanidino-2-(propylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C13H21N5O5 MolecularWeight: 327.33634

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1C(C(C=C(O1)C(=O)O)N=C(N)N)NC(=O)C

Isomeric SMILES

CCCNC(=O)C1C(C(C=C(O1)C(=O)O)N=C(N)N)NC(=O)C

InChI

InChI=1S/C13H21N5O5/c1-3-4-16-11(20)10-9(17-6(2)19)7(18-13(14)15)5-8(23-10)12(21)22/h5,7,9-10H,3-4H2,1-2H3,(H,16,20)(H,17,19)(H,21,22)(H4,14,15,18)