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

Systemtic Name: 3-acetamido-4-[bis(azanyl)methylideneamino]-2-(dipropylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: 3-acetamido-2-(dipropylcarbamoyl)-4-guanidino-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: 3-acetamido-4-(diaminomethylideneamino)-2-[(dipropylamino)-oxomethyl]-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: 3-acetamido-4-(diaminomethylideneamino)-2-(dipropylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: 3-acetamido-2-(dipropylcarbamoyl)-4-guanidino-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C16H27N5O5 MolecularWeight: 369.41608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N5O5/c1-4-6-21(7-5-2)14(23)13-12(19-9(3)22)10(20-16(17)18)8-11(26-13)15(24)25/h8,10,12-13H,4-7H2,1-3H3,(H,19,22)(H,24,25)(H4,17,18,20)