(phenylmethyl) 3-azanyl-3-(1,3-benzodioxol-5-yl)propanoate

Systemtic Name: (phenylmethyl) 3-azanyl-3-(1,3-benzodioxol-5-yl)propanoate Openeye Name: benzyl 3-amino-3-(1,3-benzodioxol-5-yl)propanoate CAS Name: 3-amino-3-(1,3-benzodioxol-5-yl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-amino-3-(1,3-benzodioxol-5-yl)propanoate Traditional Name: 3-amino-3-(1,3-benzodioxol-5-yl)propionic acid benzyl ester Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(CC(=O)OCC3=CC=CC=C3)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(CC(=O)OCC3=CC=CC=C3)N

InChI

InChI=1S/C17H17NO4/c18-14(13-6-7-15-16(8-13)22-11-21-15)9-17(19)20-10-12-4-2-1-3-5-12/h1-8,14H,9-11,18H2