N-[7-(acetamidomethyl)-2-tert-butyl-1H-indol-5-yl]-2-(1,3-benzodioxol-5-yl)pentanamide

Systemtic Name: N-[7-(acetamidomethyl)-2-tert-butyl-1H-indol-5-yl]-2-(1,3-benzodioxol-5-yl)pentanamide Openeye Name: N-[7-(acetamidomethyl)-2-tert-butyl-1H-indol-5-yl]-2-(1,3-benzodioxol-5-yl)pentanamide CAS Name: N-[7-(acetamidomethyl)-2-tert-butyl-1H-indol-5-yl]-2-(1,3-benzodioxol-5-yl)pentanamide IUPAC Name: N-[7-(acetamidomethyl)-2-tert-butyl-1H-indol-5-yl]-2-(1,3-benzodioxol-5-yl)pentanamide Traditional Name: N-[7-(acetamidomethyl)-2-tert-butyl-1H-indol-5-yl]-2-(1,3-benzodioxol-5-yl)valeramide Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC2=C(C=C1)OCO2)C(=O)NC3=CC(=C4C(=C3)C=C(N4)C(C)(C)C)CNC(=O)C

Isomeric SMILES

CCCC(C1=CC2=C(C=C1)OCO2)C(=O)NC3=CC(=C4C(=C3)C=C(N4)C(C)(C)C)CNC(=O)C

InChI

InChI=1S/C27H33N3O4/c1-6-7-21(17-8-9-22-23(12-17)34-15-33-22)26(32)29-20-10-18-13-24(27(3,4)5)30-25(18)19(11-20)14-28-16(2)31/h8-13,21,30H,6-7,14-15H2,1-5H3,(H,28,31)(H,29,32)