2-diethylaminoethyl 4-[2-(4a-methyl-1-oxidanyl-7-oxidanylidene-1,2,3,4-tetrahydronaphthalen-2-yl)propanoylamino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[2-(4a-methyl-1-oxidanyl-7-oxidanylidene-1,2,3,4-tetrahydronaphthalen-2-yl)propanoylamino]benzoate Openeye Name: 2-diethylaminoethyl 4-[2-(1-hydroxy-4a-methyl-7-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)propanoylamino]benzoate CAS Name: 4-[[2-(1-hydroxy-4a-methyl-7-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)-1-oxopropyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[2-(1-hydroxy-4a-methyl-7-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)propanoylamino]benzoate Traditional Name: 4-[2-(1-hydroxy-7-keto-4a-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)propanoylamino]benzoic acid 2-diethylaminoethyl ester Formula: C27H36N2O5 MolecularWeight: 468.58514

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)C2CCC3(C=CC(=O)C=C3C2O)C

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)C2CCC3(C=CC(=O)C=C3C2O)C

InChI

InChI=1S/C27H36N2O5/c1-5-29(6-2)15-16-34-26(33)19-7-9-20(10-8-19)28-25(32)18(3)22-12-14-27(4)13-11-21(30)17-23(27)24(22)31/h7-11,13,17-18,22,24,31H,5-6,12,14-16H2,1-4H3,(H,28,32)