1-[[2-(3,4-dimethoxyphenyl)-4-(phenylmethyl)-4H-chromen-3-yl]methyl]piperidine

Systemtic Name: 1-[[2-(3,4-dimethoxyphenyl)-4-(phenylmethyl)-4H-chromen-3-yl]methyl]piperidine Openeye Name: 1-[[4-benzyl-2-(3,4-dimethoxyphenyl)-4H-chromen-3-yl]methyl]piperidine CAS Name: 1-[[2-(3,4-dimethoxyphenyl)-4-(phenylmethyl)-4H-1-benzopyran-3-yl]methyl]piperidine IUPAC Name: 1-[[4-benzyl-2-(3,4-dimethoxyphenyl)-4H-chromen-3-yl]methyl]piperidine Traditional Name: 1-[[4-benzyl-2-(3,4-dimethoxyphenyl)-4H-chromen-3-yl]methyl]piperidine Formula: C30H33NO3 MolecularWeight: 455.58792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(C3=CC=CC=C3O2)CC4=CC=CC=C4)CN5CCCCC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(C3=CC=CC=C3O2)CC4=CC=CC=C4)CN5CCCCC5)OC

InChI

InChI=1S/C30H33NO3/c1-32-28-16-15-23(20-29(28)33-2)30-26(21-31-17-9-4-10-18-31)25(19-22-11-5-3-6-12-22)24-13-7-8-14-27(24)34-30/h3,5-8,11-16,20,25H,4,9-10,17-19,21H2,1-2H3