(phenylmethyl) 4-[[5-[(3-naphthalen-1-ylcarbonylpyrrol-1-yl)methyl]imidazol-1-yl]methyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[[5-[(3-naphthalen-1-ylcarbonylpyrrol-1-yl)methyl]imidazol-1-yl]methyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[[5-[[3-(naphthalene-1-carbonyl)pyrrol-1-yl]methyl]imidazol-1-yl]methyl]piperidine-1-carboxylate CAS Name: 4-[[5-[[3-[1-naphthalenyl(oxo)methyl]-1-pyrrolyl]methyl]-1-imidazolyl]methyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[5-[[3-(naphthalene-1-carbonyl)pyrrol-1-yl]methyl]imidazol-1-yl]methyl]piperidine-1-carboxylate Traditional Name: 4-[[5-[[3-(1-naphthoyl)pyrrol-1-yl]methyl]imidazol-1-yl]methyl]piperidine-1-carboxylic acid benzyl ester Formula: C33H32N4O3 MolecularWeight: 532.63218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C=NC=C2CN3C=CC(=C3)C(=O)C4=CC=CC5=CC=CC=C54)C(=O)OCC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1CN2C=NC=C2CN3C=CC(=C3)C(=O)C4=CC=CC5=CC=CC=C54)C(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C33H32N4O3/c38-32(31-12-6-10-27-9-4-5-11-30(27)31)28-15-16-35(21-28)22-29-19-34-24-37(29)20-25-13-17-36(18-14-25)33(39)40-23-26-7-2-1-3-8-26/h1-12,15-16,19,21,24-25H,13-14,17-18,20,22-23H2