4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)-N,N-bis(phenylmethyl)butanamide

Systemtic Name: 4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)-N,N-bis(phenylmethyl)butanamide Openeye Name: N,N-dibenzyl-4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]butanamide CAS Name: 4-[5-chloro-2-(2-quinolinyl)-1H-indol-3-yl]-N,N-bis(phenylmethyl)butanamide IUPAC Name: N,N-dibenzyl-4-(5-chloro-2-quinolin-2-yl-1H-indol-3-yl)butanamide Traditional Name: N,N-dibenzyl-4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]butyramide Formula: C35H30ClN3O MolecularWeight: 544.0852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)CCCC3=C(NC4=C3C=C(C=C4)Cl)C5=NC6=CC=CC=C6C=C5

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)CCCC3=C(NC4=C3C=C(C=C4)Cl)C5=NC6=CC=CC=C6C=C5

InChI

InChI=1S/C35H30ClN3O/c36-28-19-21-32-30(22-28)29(35(38-32)33-20-18-27-14-7-8-16-31(27)37-33)15-9-17-34(40)39(23-25-10-3-1-4-11-25)24-26-12-5-2-6-13-26/h1-8,10-14,16,18-22,38H,9,15,17,23-24H2