(2S)-N-(1,3-benzodioxol-5-ylmethyl)-2-phenylazanyl-propanamide

Systemtic Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-2-phenylazanyl-propanamide Openeye Name: (2S)-2-anilino-N-(1,3-benzodioxol-5-ylmethyl)propanamide CAS Name: (2S)-2-anilino-N-(1,3-benzodioxol-5-ylmethyl)propanamide IUPAC Name: (2S)-2-anilino-N-(1,3-benzodioxol-5-ylmethyl)propanamide Traditional Name: (2S)-2-anilino-N-piperonyl-propionamide Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)NC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC2=C(C=C1)OCO2)NC3=CC=CC=C3

InChI

InChI=1S/C17H18N2O3/c1-12(19-14-5-3-2-4-6-14)17(20)18-10-13-7-8-15-16(9-13)22-11-21-15/h2-9,12,19H,10-11H2,1H3,(H,18,20)/t12-/m0/s1