ethyl N-[1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: ethyl N-[1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: ethyl N-[1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazine-1-carbonyl]-2-methyl-propyl]carbamate CAS Name: N-[1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazine-1-carbonyl]-2-methyl-propyl]carbamic acid ethyl ester Formula: C21H31N3O5 MolecularWeight: 405.48794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(C(C)C)C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCOC(=O)NC(C(C)C)C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H31N3O5/c1-4-27-21(26)22-19(15(2)3)20(25)24-9-7-23(8-10-24)14-16-5-6-17-18(13-16)29-12-11-28-17/h5-6,13,15,19H,4,7-12,14H2,1-3H3,(H,22,26)