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ethyl (4R)-4-(1,3-benzodioxol-5-yl)-2-methylidene-4-[(phenylmethyl)amino]butanoate

ethyl (4R)-4-(1,3-benzodioxol-5-yl)-2-methylidene-4-[(phenylmethyl)amino]butanoate

Systemtic Name:ethyl (4R)-4-(1,3-benzodioxol-5-yl)-2-methylidene-4-[(phenylmethyl)amino]butanoate
Openeye Name:ethyl (4R)-4-(1,3-benzodioxol-5-yl)-4-(benzylamino)-2-methylene-butanoate
CAS Name:(4R)-4-(1,3-benzodioxol-5-yl)-2-methylene-4-[(phenylmethyl)amino]butanoic acid ethyl ester
IUPAC Name:ethyl (4R)-4-(1,3-benzodioxol-5-yl)-4-(benzylamino)-2-methylidenebutanoate
Traditional Name:2-[(2R)-2-(1,3-benzodioxol-5-yl)-2-(benzylamino)ethyl]acrylic acid ethyl ester
Formula: C21H23NO4
MolecularWeight: 353.41162
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C)CC(C1=CC2=C(C=C1)OCO2)NCC3=CC=CC=C3


Isomeric SMILES

CCOC(=O)C(=C)C[C@H](C1=CC2=C(C=C1)OCO2)NCC3=CC=CC=C3


InChI

InChI=1S/C21H23NO4/c1-3-24-21(23)15(2)11-18(22-13-16-7-5-4-6-8-16)17-9-10-19-20(12-17)26-14-25-19/h4-10,12,18,22H,2-3,11,13-14H2,1H3/t18-/m1/s1


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