methyl 3-[[3-(2-hexadecoxyphenyl)-3-oxidanylidene-propanoyl]amino]-4-methoxy-benzoate

Systemtic Name: methyl 3-[[3-(2-hexadecoxyphenyl)-3-oxidanylidene-propanoyl]amino]-4-methoxy-benzoate Openeye Name: methyl 3-[[3-(2-hexadecoxyphenyl)-3-oxo-propanoyl]amino]-4-methoxy-benzoate CAS Name: 3-[[3-(2-hexadecoxyphenyl)-1,3-dioxopropyl]amino]-4-methoxybenzoic acid methyl ester IUPAC Name: methyl 3-[[3-(2-hexadecoxyphenyl)-3-oxopropanoyl]amino]-4-methoxybenzoate Traditional Name: 3-[[3-(2-cetyloxyphenyl)-3-keto-propanoyl]amino]-4-methoxy-benzoic acid methyl ester Formula: C34H49NO6 MolecularWeight: 567.75596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=CC=C1C(=O)CC(=O)NC2=C(C=CC(=C2)C(=O)OC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=CC=C1C(=O)CC(=O)NC2=C(C=CC(=C2)C(=O)OC)OC

InChI

InChI=1S/C34H49NO6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24-41-31-21-18-17-20-28(31)30(36)26-33(37)35-29-25-27(34(38)40-3)22-23-32(29)39-2/h17-18,20-23,25H,4-16,19,24,26H2,1-3H3,(H,35,37)