N-[2-[2-azanylpropanoyl-[(E)-octadec-9-enoyl]amino]propanoyl]-N-(3-methyl-1-oxidanyl-butan-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: N-[2-[2-azanylpropanoyl-[(E)-octadec-9-enoyl]amino]propanoyl]-N-(3-methyl-1-oxidanyl-butan-2-yl)pyrrolidine-2-carboxamide Openeye Name: N-[2-[2-aminopropanoyl-[(E)-octadec-9-enoyl]amino]propanoyl]-N-[1-(hydroxymethyl)-2-methyl-propyl]pyrrolidine-2-carboxamide CAS Name: N-[2-[(2-amino-1-oxopropyl)-[(E)-1-oxooctadec-9-enyl]amino]-1-oxopropyl]-N-(1-hydroxy-3-methylbutan-2-yl)-2-pyrrolidinecarboxamide IUPAC Name: N-[2-[2-aminopropanoyl-[(E)-octadec-9-enoyl]amino]propanoyl]-N-(1-hydroxy-3-methylbutan-2-yl)pyrrolidine-2-carboxamide Traditional Name: N-[2-[alanyl-[(E)-octadec-9-enoyl]amino]propanoyl]-N-(2-methyl-1-methylol-propyl)pyrrolidine-2-carboxamide Formula: C34H62N4O5 MolecularWeight: 606.87988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)N(C(C)C(=O)N(C(CO)C(C)C)C(=O)C1CCCN1)C(=O)C(C)N

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)N(C(C)C(=O)N(C(CO)C(C)C)C(=O)C1CCCN1)C(=O)C(C)N

InChI

InChI=1S/C34H62N4O5/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-31(40)37(32(41)27(4)35)28(5)33(42)38(30(25-39)26(2)3)34(43)29-22-21-24-36-29/h13-14,26-30,36,39H,6-12,15-25,35H2,1-5H3/b14-13+