2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethyl N-(2-phenylpropyl)carbamate

Systemtic Name: 2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethyl N-(2-phenylpropyl)carbamate Openeye Name: 2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethyl N-(2-phenylpropyl)carbamate CAS Name: N-(2-phenylpropyl)carbamic acid 2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl]ethyl N-(2-phenylpropyl)carbamate Traditional Name: N-(2-phenylpropyl)carbamic acid 2-[4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazino]ethyl ester Formula: C25H33N3O5 MolecularWeight: 455.54662

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)OCCN1CCN(CC1)CC2=CC3=C(C(=C2)OC)OCO3)C4=CC=CC=C4

Isomeric SMILES

CC(CNC(=O)OCCN1CCN(CC1)CC2=CC3=C(C(=C2)OC)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C25H33N3O5/c1-19(21-6-4-3-5-7-21)16-26-25(29)31-13-12-27-8-10-28(11-9-27)17-20-14-22(30-2)24-23(15-20)32-18-33-24/h3-7,14-15,19H,8-13,16-18H2,1-2H3,(H,26,29)