(2S)-2-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-3-(1H-indol-3-yl)propanamide

Systemtic Name: (2S)-2-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-3-(1H-indol-3-yl)propanamide Openeye Name: (2S)-2-amino-N-(1,3-benzodioxol-5-ylmethyl)-3-(1H-indol-3-yl)propanamide CAS Name: (2S)-2-amino-N-(1,3-benzodioxol-5-ylmethyl)-3-(1H-indol-3-yl)propanamide IUPAC Name: (2S)-2-amino-N-(1,3-benzodioxol-5-ylmethyl)-3-(1H-indol-3-yl)propanamide Traditional Name: (2S)-2-amino-3-(1H-indol-3-yl)-N-piperonyl-propionamide Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(CC3=CNC4=CC=CC=C43)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)[C@H](CC3=CNC4=CC=CC=C43)N

InChI

InChI=1S/C19H19N3O3/c20-15(8-13-10-21-16-4-2-1-3-14(13)16)19(23)22-9-12-5-6-17-18(7-12)25-11-24-17/h1-7,10,15,21H,8-9,11,20H2,(H,22,23)/t15-/m0/s1