ethyl (4R)-4-[bis(phenylmethyl)amino]-5-(4-methoxyphenyl)-3-oxidanylidene-pentanoate

Systemtic Name: ethyl (4R)-4-[bis(phenylmethyl)amino]-5-(4-methoxyphenyl)-3-oxidanylidene-pentanoate Openeye Name: ethyl (4R)-4-(dibenzylamino)-5-(4-methoxyphenyl)-3-oxo-pentanoate CAS Name: (4R)-4-[bis(phenylmethyl)amino]-5-(4-methoxyphenyl)-3-oxopentanoic acid ethyl ester IUPAC Name: ethyl (4R)-4-(dibenzylamino)-5-(4-methoxyphenyl)-3-oxopentanoate Traditional Name: (4R)-4-(dibenzylamino)-3-keto-5-(4-methoxyphenyl)valeric acid ethyl ester Formula: C28H31NO4 MolecularWeight: 445.55004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)C(CC1=CC=C(C=C1)OC)N(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC(=O)[C@@H](CC1=CC=C(C=C1)OC)N(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C28H31NO4/c1-3-33-28(31)19-27(30)26(18-22-14-16-25(32-2)17-15-22)29(20-23-10-6-4-7-11-23)21-24-12-8-5-9-13-24/h4-17,26H,3,18-21H2,1-2H3/t26-/m1/s1