diethyl 2-acetamido-2-[[3-[[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]methyl]phenyl]methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[[3-[[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]methyl]phenyl]methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[[3-[[4-(2-isopropoxyphenyl)piperazin-1-yl]methyl]phenyl]methyl]propanedioate CAS Name: 2-acetamido-2-[[3-[[4-(2-propan-2-yloxyphenyl)-1-piperazinyl]methyl]phenyl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[[3-[[4-(2-propan-2-yloxyphenyl)piperazin-1-yl]methyl]phenyl]methyl]propanedioate Traditional Name: 2-acetamido-2-[3-[[4-(2-isopropoxyphenyl)piperazino]methyl]benzyl]malonic acid diethyl ester Formula: C30H41N3O6 MolecularWeight: 539.66304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=CC=C1)CN2CCN(CC2)C3=CC=CC=C3OC(C)C)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CC(=CC=C1)CN2CCN(CC2)C3=CC=CC=C3OC(C)C)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C30H41N3O6/c1-6-37-28(35)30(31-23(5)34,29(36)38-7-2)20-24-11-10-12-25(19-24)21-32-15-17-33(18-16-32)26-13-8-9-14-27(26)39-22(3)4/h8-14,19,22H,6-7,15-18,20-21H2,1-5H3,(H,31,34)