3-ethoxy-4-[(2R)-1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl]oxy-benzaldehyde

Systemtic Name: 3-ethoxy-4-[(2R)-1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl]oxy-benzaldehyde Openeye Name: 4-[(1R)-2-(4-benzylpiperazin-1-yl)-1-methyl-2-oxo-ethoxy]-3-ethoxy-benzaldehyde CAS Name: 3-ethoxy-4-[(2R)-1-oxo-1-[4-(phenylmethyl)-1-piperazinyl]propan-2-yl]oxybenzaldehyde IUPAC Name: 4-[(2R)-1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl]oxy-3-ethoxybenzaldehyde Traditional Name: 4-[(1R)-2-(4-benzylpiperazino)-2-keto-1-methyl-ethoxy]-3-ethoxy-benzaldehyde Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=O)OC(C)C(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=O)O[C@H](C)C(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H28N2O4/c1-3-28-22-15-20(17-26)9-10-21(22)29-18(2)23(27)25-13-11-24(12-14-25)16-19-7-5-4-6-8-19/h4-10,15,17-18H,3,11-14,16H2,1-2H3/t18-/m1/s1