phenyl 5-[bis(phenylmethyl)amino]-7-methyl-4-oxidanyl-octanoate

Systemtic Name: phenyl 5-[bis(phenylmethyl)amino]-7-methyl-4-oxidanyl-octanoate Openeye Name: phenyl 5-(dibenzylamino)-4-hydroxy-7-methyl-octanoate CAS Name: 5-[bis(phenylmethyl)amino]-4-hydroxy-7-methyloctanoic acid phenyl ester IUPAC Name: phenyl 5-(dibenzylamino)-4-hydroxy-7-methyloctanoate Traditional Name: 5-(dibenzylamino)-4-hydroxy-7-methyl-caprylic acid phenyl ester Formula: C29H35NO3 MolecularWeight: 445.5931

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CCC(=O)OC1=CC=CC=C1)O)N(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(CCC(=O)OC1=CC=CC=C1)O)N(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C29H35NO3/c1-23(2)20-27(28(31)18-19-29(32)33-26-16-10-5-11-17-26)30(21-24-12-6-3-7-13-24)22-25-14-8-4-9-15-25/h3-17,23,27-28,31H,18-22H2,1-2H3