4-(5-chloranyl-2-pyridin-2-yl-1H-indol-3-yl)-N-hexadecyl-butanamide

Systemtic Name: 4-(5-chloranyl-2-pyridin-2-yl-1H-indol-3-yl)-N-hexadecyl-butanamide Openeye Name: 4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]-N-hexadecyl-butanamide CAS Name: 4-[5-chloro-2-(2-pyridinyl)-1H-indol-3-yl]-N-hexadecylbutanamide IUPAC Name: 4-(5-chloro-2-pyridin-2-yl-1H-indol-3-yl)-N-hexadecylbutanamide Traditional Name: N-cetyl-4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]butyramide Formula: C33H48ClN3O MolecularWeight: 538.20672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)CCCC1=C(NC2=C1C=C(C=C2)Cl)C3=CC=CC=N3

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=O)CCCC1=C(NC2=C1C=C(C=C2)Cl)C3=CC=CC=N3

InChI

InChI=1S/C33H48ClN3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-25-36-32(38)21-18-19-28-29-26-27(34)22-23-30(29)37-33(28)31-20-15-17-24-35-31/h15,17,20,22-24,26,37H,2-14,16,18-19,21,25H2,1H3,(H,36,38)