(phenylmethyl) N-(1-oxidanylhexyl)-N-[4-[(phenylmethyl)-propan-2-yl-amino]butyl]carbamate

Systemtic Name: (phenylmethyl) N-(1-oxidanylhexyl)-N-[4-[(phenylmethyl)-propan-2-yl-amino]butyl]carbamate Openeye Name: benzyl N-[4-[benzyl(isopropyl)amino]butyl]-N-(1-hydroxyhexyl)carbamate CAS Name: N-(1-hydroxyhexyl)-N-[4-[(phenylmethyl)-propan-2-ylamino]butyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-[benzyl(propan-2-yl)amino]butyl]-N-(1-hydroxyhexyl)carbamate Traditional Name: N-[4-[benzyl(isopropyl)amino]butyl]-N-(1-hydroxyhexyl)carbamic acid benzyl ester Formula: C28H42N2O3 MolecularWeight: 454.64468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(N(CCCCN(CC1=CC=CC=C1)C(C)C)C(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

CCCCCC(N(CCCCN(CC1=CC=CC=C1)C(C)C)C(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C28H42N2O3/c1-4-5-8-19-27(31)30(28(32)33-23-26-17-11-7-12-18-26)21-14-13-20-29(24(2)3)22-25-15-9-6-10-16-25/h6-7,9-12,15-18,24,27,31H,4-5,8,13-14,19-23H2,1-3H3