methyl 3-[2-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)amino]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)amino]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)amino]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)amino]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)amino]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(ethyl)amino]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1COC2=CC=CC=C2O1)CC(=O)NC3=C(C=CC(=C3)C(=O)OC)C

Isomeric SMILES

CCN(CC1COC2=CC=CC=C2O1)CC(=O)NC3=C(C=CC(=C3)C(=O)OC)C

InChI

InChI=1S/C22H26N2O5/c1-4-24(12-17-14-28-19-7-5-6-8-20(19)29-17)13-21(25)23-18-11-16(22(26)27-3)10-9-15(18)2/h5-11,17H,4,12-14H2,1-3H3,(H,23,25)