(2S)-2-(1,3-benzodioxol-5-ylamino)-N-[(phenylmethyl)carbamoyl]propanamide

Systemtic Name: (2S)-2-(1,3-benzodioxol-5-ylamino)-N-[(phenylmethyl)carbamoyl]propanamide Openeye Name: (2S)-2-(1,3-benzodioxol-5-ylamino)-N-(benzylcarbamoyl)propanamide CAS Name: (2S)-2-(1,3-benzodioxol-5-ylamino)-N-[oxo-[(phenylmethyl)amino]methyl]propanamide IUPAC Name: (2S)-2-(1,3-benzodioxol-5-ylamino)-N-(benzylcarbamoyl)propanamide Traditional Name: (2S)-2-(1,3-benzodioxol-5-ylamino)-N-(benzylcarbamoyl)propionamide Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NCC1=CC=CC=C1)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NCC1=CC=CC=C1)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H19N3O4/c1-12(20-14-7-8-15-16(9-14)25-11-24-15)17(22)21-18(23)19-10-13-5-3-2-4-6-13/h2-9,12,20H,10-11H2,1H3,(H2,19,21,22,23)/t12-/m0/s1