methyl 2-[cyclohexylmethyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]ethanoate

Systemtic Name: methyl 2-[cyclohexylmethyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]ethanoate Openeye Name: methyl 2-[(1-benzylpyrrol-2-yl)methyl-(cyclohexylmethyl)amino]acetate CAS Name: 2-[cyclohexylmethyl-[[1-(phenylmethyl)-2-pyrrolyl]methyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[(1-benzylpyrrol-2-yl)methyl-(cyclohexylmethyl)amino]acetate Traditional Name: 2-[(1-benzylpyrrol-2-yl)methyl-(cyclohexylmethyl)amino]acetic acid methyl ester Formula: C22H30N2O2 MolecularWeight: 354.4858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN(CC1CCCCC1)CC2=CC=CN2CC3=CC=CC=C3

Isomeric SMILES

COC(=O)CN(CC1CCCCC1)CC2=CC=CN2CC3=CC=CC=C3

InChI

InChI=1S/C22H30N2O2/c1-26-22(25)18-23(15-19-9-4-2-5-10-19)17-21-13-8-14-24(21)16-20-11-6-3-7-12-20/h3,6-8,11-14,19H,2,4-5,9-10,15-18H2,1H3