N-[(E,13R)-14-azanyl-13,15-bis(oxidanyl)pentadec-11-enyl]pyrene-1-carboxamide

Systemtic Name: N-[(E,13R)-14-azanyl-13,15-bis(oxidanyl)pentadec-11-enyl]pyrene-1-carboxamide Openeye Name: N-[(E,13R)-14-amino-13,15-dihydroxy-pentadec-11-enyl]pyrene-1-carboxamide CAS Name: N-[(E,13R)-14-amino-13,15-dihydroxypentadec-11-enyl]-1-pyrenecarboxamide IUPAC Name: N-[(E,13R)-14-amino-13,15-dihydroxypentadec-11-enyl]pyrene-1-carboxamide Traditional Name: N-[(E,13R)-14-amino-13,15-dihydroxy-pentadec-11-enyl]pyrene-1-carboxamide Formula: C32H40N2O3 MolecularWeight: 500.6716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C(=O)NCCCCCCCCCCC=CC(C(CO)N)O

Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C(=O)NCCCCCCCCCC/C=C/[C@H](C(CO)N)O

InChI

InChI=1S/C32H40N2O3/c33-28(22-35)29(36)14-9-7-5-3-1-2-4-6-8-10-21-34-32(37)27-20-18-25-16-15-23-12-11-13-24-17-19-26(27)31(25)30(23)24/h9,11-20,28-29,35-36H,1-8,10,21-22,33H2,(H,34,37)/b14-9+/t28?,29-/m1/s1