5-[(16Z,19Z,22Z)-pentacosa-16,19,22-trienyl]-1H-pyrrole-2-carbaldehyde

Systemtic Name: 5-[(16Z,19Z,22Z)-pentacosa-16,19,22-trienyl]-1H-pyrrole-2-carbaldehyde Openeye Name: 5-[(16Z,19Z,22Z)-pentacosa-16,19,22-trienyl]-1H-pyrrole-2-carbaldehyde CAS Name: 5-[(16Z,19Z,22Z)-pentacosa-16,19,22-trienyl]-1H-pyrrole-2-carboxaldehyde IUPAC Name: 5-[(16Z,19Z,22Z)-pentacosa-16,19,22-trienyl]-1H-pyrrole-2-carbaldehyde Traditional Name: 5-[(16Z,19Z,22Z)-pentacosa-16,19,22-trienyl]-1H-pyrrole-2-carbaldehyde Formula: C30H49NO MolecularWeight: 439.71616

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC=CCC=CCCCCCCCCCCCCCCCC1=CC=C(N1)C=O

Isomeric SMILES

CC/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCC1=CC=C(N1)C=O

InChI

InChI=1S/C30H49NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29-26-27-30(28-32)31-29/h3-4,6-7,9-10,26-28,31H,2,5,8,11-25H2,1H3/b4-3-,7-6-,10-9-