methyl 4-acetamido-5-azanyl-3-pentan-3-yloxy-cyclohexene-1-carboxylate; phosphoric acid

Systemtic Name: methyl 4-acetamido-5-azanyl-3-pentan-3-yloxy-cyclohexene-1-carboxylate; phosphoric acid Openeye Name: methyl 4-acetamido-5-amino-3-(1-ethylpropoxy)cyclohexene-1-carboxylate; phosphoric acid CAS Name: 4-acetamido-5-amino-3-pentan-3-yloxy-1-cyclohexenecarboxylic acid methyl ester; phosphoric acid IUPAC Name: methyl 4-acetamido-5-amino-3-pentan-3-yloxycyclohexene-1-carboxylate; phosphoric acid Traditional Name: 4-acetamido-5-amino-3-(1-ethylpropoxy)cyclohexene-1-carboxylic acid methyl ester; phosphoric acid Formula: C15H29N2O8P MolecularWeight: 396.373121

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1C=C(CC(C1NC(=O)C)N)C(=O)OC.OP(=O)(O)O

Isomeric SMILES

CCC(CC)OC1C=C(CC(C1NC(=O)C)N)C(=O)OC.OP(=O)(O)O

InChI

InChI=1S/C15H26N2O4.H3O4P/c1-5-11(6-2)21-13-8-10(15(19)20-4)7-12(16)14(13)17-9(3)18;1-5(2,3)4/h8,11-14H,5-7,16H2,1-4H3,(H,17,18);(H3,1,2,3,4)