zinc 4-[(phenylmethyl)-propyl-amino]butyl 2,2-dimethylpropanoate

Systemtic Name: zinc 4-[(phenylmethyl)-propyl-amino]butyl 2,2-dimethylpropanoate Openeye Name: zinc 4-[benzyl(propyl)amino]butyl 2,2-dimethylpropanoate CAS Name: zinc 2,2-dimethylpropanoic acid 4-[(phenylmethyl)-propylamino]butyl ester IUPAC Name: zinc 4-[benzyl(propyl)amino]butyl 2,2-dimethylpropanoate Traditional Name: zinc 2,2-dimethylpropionic acid 4-[benzyl(propyl)amino]butyl ester Formula: C38H60N2O4Zn MolecularWeight: 674.303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCCCCN(CC[CH2-])CC1=CC=CC=C1.CC(C)(C)C(=O)OCCCCN(CC[CH2-])CC1=CC=CC=C1.[Zn+2]

Isomeric SMILES

CC(C)(C)C(=O)OCCCCN(CC[CH2-])CC1=CC=CC=C1.CC(C)(C)C(=O)OCCCCN(CC[CH2-])CC1=CC=CC=C1.[Zn+2]

InChI

InChI=1S/2C19H30NO2.Zn/c2*1-5-13-20(16-17-11-7-6-8-12-17)14-9-10-15-22-18(21)19(2,3)4;/h2*6-8,11-12H,1,5,9-10,13-16H2,2-4H3;/q2*-1;+2