methyl 5-[bis(phenylmethyl)amino]-4-methyl-4-oxidanyl-5-oxidanylidene-pent-2-ynoate

Systemtic Name: methyl 5-[bis(phenylmethyl)amino]-4-methyl-4-oxidanyl-5-oxidanylidene-pent-2-ynoate Openeye Name: methyl 5-(dibenzylamino)-4-hydroxy-4-methyl-5-oxo-pent-2-ynoate CAS Name: 5-[bis(phenylmethyl)amino]-4-hydroxy-4-methyl-5-oxo-2-pentynoic acid methyl ester IUPAC Name: methyl 5-(dibenzylamino)-4-hydroxy-4-methyl-5-oxopent-2-ynoate Traditional Name: 5-(dibenzylamino)-4-hydroxy-5-keto-4-methyl-pent-2-ynoic acid methyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC(=O)OC)(C(=O)N(CC1=CC=CC=C1)CC2=CC=CC=C2)O

Isomeric SMILES

CC(C#CC(=O)OC)(C(=O)N(CC1=CC=CC=C1)CC2=CC=CC=C2)O

InChI

InChI=1S/C21H21NO4/c1-21(25,14-13-19(23)26-2)20(24)22(15-17-9-5-3-6-10-17)16-18-11-7-4-8-12-18/h3-12,25H,15-16H2,1-2H3