3-acetamido-4-azanyl-2-[nonyl(propyl)carbamoyl]-3,4-dihydro-2H-pyran-6-carboxylic acid

Systemtic Name: 3-acetamido-4-azanyl-2-[nonyl(propyl)carbamoyl]-3,4-dihydro-2H-pyran-6-carboxylic acid Openeye Name: 3-acetamido-4-amino-2-[nonyl(propyl)carbamoyl]-3,4-dihydro-2H-pyran-6-carboxylic acid CAS Name: 3-acetamido-4-amino-2-[[nonyl(propyl)amino]-oxomethyl]-3,4-dihydro-2H-pyran-6-carboxylic acid IUPAC Name: 3-acetamido-4-amino-2-[nonyl(propyl)carbamoyl]-3,4-dihydro-2H-pyran-6-carboxylic acid Traditional Name: 3-acetamido-4-amino-2-[nonyl(propyl)carbamoyl]-3,4-dihydro-2H-pyran-6-carboxylic acid Formula: C21H37N3O5 MolecularWeight: 411.53558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H37N3O5/c1-4-6-7-8-9-10-11-13-24(12-5-2)20(26)19-18(23-15(3)25)16(22)14-17(29-19)21(27)28/h14,16,18-19H,4-13,22H2,1-3H3,(H,23,25)(H,27,28)