N-(3-butoxypropyl)-2-[1-(1-methylindol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]propanamide

Systemtic Name: N-(3-butoxypropyl)-2-[1-(1-methylindol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]propanamide Openeye Name: N-(3-butoxypropyl)-2-[1-(1-methylindol-3-yl)-3-oxo-isoindolin-2-yl]propanamide CAS Name: N-(3-butoxypropyl)-2-[1-(1-methyl-3-indolyl)-3-oxo-1H-isoindol-2-yl]propanamide IUPAC Name: N-(3-butoxypropyl)-2-[1-(1-methylindol-3-yl)-3-oxo-1H-isoindol-2-yl]propanamide Traditional Name: N-(3-butoxypropyl)-2-[1-keto-3-(1-methylindol-3-yl)isoindolin-2-yl]propionamide Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCNC(=O)C(C)N1C(C2=CC=CC=C2C1=O)C3=CN(C4=CC=CC=C43)C

Isomeric SMILES

CCCCOCCCNC(=O)C(C)N1C(C2=CC=CC=C2C1=O)C3=CN(C4=CC=CC=C43)C

InChI

InChI=1S/C27H33N3O3/c1-4-5-16-33-17-10-15-28-26(31)19(2)30-25(21-12-6-7-13-22(21)27(30)32)23-18-29(3)24-14-9-8-11-20(23)24/h6-9,11-14,18-19,25H,4-5,10,15-17H2,1-3H3,(H,28,31)