N-[11-(2-chloranylethanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]-2-propyl-pentanamide

Systemtic Name: N-[11-(2-chloranylethanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]-2-propyl-pentanamide Openeye Name: N-[11-(2-chloroacetyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]-2-propyl-pentanamide CAS Name: N-[11-(2-chloro-1-oxoethyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]-2-propylpentanamide IUPAC Name: N-[11-(2-chloroacetyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]-2-propylpentanamide Traditional Name: N-[11-(2-chloroacetyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]-2-propyl-valeramide Formula: C24H29ClN2O2 MolecularWeight: 412.95226

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)CCl)C=C1

Isomeric SMILES

CCCC(CCC)C(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)CCl)C=C1

InChI

InChI=1S/C24H29ClN2O2/c1-3-7-19(8-4-2)24(29)26-20-14-13-18-12-11-17-9-5-6-10-21(17)27(22(18)15-20)23(28)16-25/h5-6,9-10,13-15,19H,3-4,7-8,11-12,16H2,1-2H3,(H,26,29)