3-[5-nitro-1-(phenylmethyl)indol-3-yl]-N-pentyl-3-phenyl-propanamide

Systemtic Name: 3-[5-nitro-1-(phenylmethyl)indol-3-yl]-N-pentyl-3-phenyl-propanamide Openeye Name: 3-(1-benzyl-5-nitro-indol-3-yl)-N-pentyl-3-phenyl-propanamide CAS Name: 3-[5-nitro-1-(phenylmethyl)-3-indolyl]-N-pentyl-3-phenylpropanamide IUPAC Name: 3-(1-benzyl-5-nitroindol-3-yl)-N-pentyl-3-phenylpropanamide Traditional Name: N-amyl-3-(1-benzyl-5-nitro-indol-3-yl)-3-phenyl-propionamide Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CC(C1=CC=CC=C1)C2=CN(C3=C2C=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

CCCCCNC(=O)CC(C1=CC=CC=C1)C2=CN(C3=C2C=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C29H31N3O3/c1-2-3-10-17-30-29(33)19-25(23-13-8-5-9-14-23)27-21-31(20-22-11-6-4-7-12-22)28-16-15-24(32(34)35)18-26(27)28/h4-9,11-16,18,21,25H,2-3,10,17,19-20H2,1H3,(H,30,33)