4-[7-[3-oxidanylidenebutyl-(phenylmethyl)amino]heptyl-(phenylmethyl)amino]butan-2-one

Systemtic Name: 4-[7-[3-oxidanylidenebutyl-(phenylmethyl)amino]heptyl-(phenylmethyl)amino]butan-2-one Openeye Name: 4-[benzyl-[7-[benzyl(3-oxobutyl)amino]heptyl]amino]butan-2-one CAS Name: 4-[7-[3-oxobutyl-(phenylmethyl)amino]heptyl-(phenylmethyl)amino]-2-butanone IUPAC Name: 4-[benzyl-[7-[benzyl(3-oxobutyl)amino]heptyl]amino]butan-2-one Traditional Name: 4-[benzyl-[7-[benzyl(3-ketobutyl)amino]heptyl]amino]butan-2-one Formula: C29H42N2O2 MolecularWeight: 450.65598

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCN(CCCCCCCN(CCC(=O)C)CC1=CC=CC=C1)CC2=CC=CC=C2

Isomeric SMILES

CC(=O)CCN(CCCCCCCN(CCC(=O)C)CC1=CC=CC=C1)CC2=CC=CC=C2

InChI

InChI=1S/C29H42N2O2/c1-26(32)18-22-30(24-28-14-8-6-9-15-28)20-12-4-3-5-13-21-31(23-19-27(2)33)25-29-16-10-7-11-17-29/h6-11,14-17H,3-5,12-13,18-25H2,1-2H3