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

Systemtic Name: 3-acetamido-4-[bis(azanyl)methylideneamino]-2-(butan-2-ylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: 3-acetamido-4-guanidino-2-(sec-butylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: 3-acetamido-2-[(butan-2-ylamino)-oxomethyl]-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: 3-acetamido-2-(butan-2-ylcarbamoyl)-4-(diaminomethylideneamino)-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: 3-acetamido-4-guanidino-2-(sec-butylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C14H23N5O5 MolecularWeight: 341.36292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23N5O5/c1-4-6(2)17-12(21)11-10(18-7(3)20)8(19-14(15)16)5-9(24-11)13(22)23/h5-6,8,10-11H,4H2,1-3H3,(H,17,21)(H,18,20)(H,22,23)(H4,15,16,19)