methyl 4-[(6-methyl-7-oxidanyl-6-phenyl-heptyl)carbamoylamino]butanoate

Systemtic Name: methyl 4-[(6-methyl-7-oxidanyl-6-phenyl-heptyl)carbamoylamino]butanoate Openeye Name: methyl 4-[(7-hydroxy-6-methyl-6-phenyl-heptyl)carbamoylamino]butanoate CAS Name: 4-[[[(7-hydroxy-6-methyl-6-phenylheptyl)amino]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(7-hydroxy-6-methyl-6-phenylheptyl)carbamoylamino]butanoate Traditional Name: 4-[(7-hydroxy-6-methyl-6-phenyl-heptyl)carbamoylamino]butyric acid methyl ester Formula: C20H32N2O4 MolecularWeight: 364.47908

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCNC(=O)NCCCC(=O)OC)(CO)C1=CC=CC=C1

Isomeric SMILES

CC(CCCCCNC(=O)NCCCC(=O)OC)(CO)C1=CC=CC=C1

InChI

InChI=1S/C20H32N2O4/c1-20(16-23,17-10-5-3-6-11-17)13-7-4-8-14-21-19(25)22-15-9-12-18(24)26-2/h3,5-6,10-11,23H,4,7-9,12-16H2,1-2H3,(H2,21,22,25)