3,5-dimethyl-4-[[4-(phenylmethyl)piperidin-1-yl]methyl]-1H-pyrrole-2-carbaldehyde

Systemtic Name: 3,5-dimethyl-4-[[4-(phenylmethyl)piperidin-1-yl]methyl]-1H-pyrrole-2-carbaldehyde Openeye Name: 4-[(4-benzyl-1-piperidyl)methyl]-3,5-dimethyl-1H-pyrrole-2-carbaldehyde CAS Name: 3,5-dimethyl-4-[[4-(phenylmethyl)-1-piperidinyl]methyl]-1H-pyrrole-2-carboxaldehyde IUPAC Name: 4-[(4-benzylpiperidin-1-yl)methyl]-3,5-dimethyl-1H-pyrrole-2-carbaldehyde Traditional Name: 4-[(4-benzylpiperidino)methyl]-3,5-dimethyl-1H-pyrrole-2-carbaldehyde Formula: C20H26N2O MolecularWeight: 310.43324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1CN2CCC(CC2)CC3=CC=CC=C3)C)C=O

Isomeric SMILES

CC1=C(NC(=C1CN2CCC(CC2)CC3=CC=CC=C3)C)C=O

InChI

InChI=1S/C20H26N2O/c1-15-19(16(2)21-20(15)14-23)13-22-10-8-18(9-11-22)12-17-6-4-3-5-7-17/h3-7,14,18,21H,8-13H2,1-2H3